DNA Alkylator/Crosslinker

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  1. Busulfan, DNA inhibitor
    CAS: 55-98-1 EC Number: 200-250-2 Formula: C6H14O6S2 Molecular Weight: 246.3
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥90%
    ● In Stock — US warehouse, ships to EU* Item #: B579871
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    IUPAC Name
    4-methylsulfonyloxybutyl methanesulfonate
    SMILES
    CS(=O)(=O)OCCCCOS(=O)(=O)C
    InChIKey
    COVZYZSDYWQREU-UHFFFAOYSA-N
    InChI
    1S/C6H14O6S2/c1-13(7,8)11-5-3-4-6-12-14(2,9)10/h3-6H2,1-2H3
    Synonyms
    DTXSID3020910 | 2041 C. B. | BUSULFAN [VANDF] | Mielosan | Tetramethylene {bis[methanesulfonate]} | TETRAMETHYLENE DI...
  2. melphalan flufenamide
    CAS: 380449-51-4 PubChem CID: 9935639
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
    ◐ .Made to order · 8–12 wks Item #: M611785
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    IUPAC Name
    ethyl (2S)-2-[[(2S)-2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoyl]amino]-3-(4-fluorophenyl)propanoate
    SMILES
    ClCCN(c1ccc(cc1)C[C@@H](C(=O)N[C@H](C(=O)OCC)Cc1ccc(cc1)F)N)CCCl
    InChIKey
    YQZNKYXGZSVEHI-VXKWHMMOSA-N
    InChI
    1S/C24H30Cl2FN3O3/c1-2-33-24(32)22(16-18-3-7-19(27)8-4-18)29-23(31)21(28)15-17-5-9-20(10-6-17)30(13-11-25)14-12-26/h3-10,21-22H,2,11-16,28H2,1H3,(H,29show more
    Synonyms
    (+/-)-Hyoscyamine | Melflufen | MELPHALAN FLUFENAMIDE [USAN] | Q27277739 | D11865 | F70C5K4786 | HY-105019 | Melphala...
  3. Duocarmycin Analog
    CAS: 372954-15-9 PubChem CID: 101150096 Formula: C34H31ClN4O5 Molecular Weight: 611.09
    ◐ .Made to order · 8–12 wks Item #: D646181
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    IUPAC Name
    tert-butyl N-[4-[[2-[(1S)-1-(chloromethyl)-5-hydroxy-1,2-dihydrobenzo[e]indole-3-carbonyl]-1H-indol-5-yl]carbamoyl]phenyl]carbamate
    SMILES
    CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)NC(=C3)C(=O)N4CC(C5=C4C=C(C6=CC=CC=C65)O)CCl
    InChIKey
    JPKOARKDKWYROQ-OAQYLSRUSA-N
    InChI
    1S/C34H31ClN4O5/c1-34(2,3)44-33(43)37-22-10-8-19(9-11-22)31(41)36-23-12-13-26-20(14-23)15-27(38-26)32(42)39-18-21(17-35)30-25-7-5-4-6-24(25)29(40)16-2show more
  4. Tesirine
    CAS: 1595275-62-9 PubChem CID: 73672523 Formula: C75H101N9O23 Molecular Weight: 1496.65
    ◐ .Made to order · 8–12 wks Item #: T646379
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    SMILES
    CC1=CN2[C@@H](C1)C=NC3=CC(=C(C=C3C2=O)OC)OCCCCCOC4=C(C=C5C(=C4)N([C@H]([C@@H]6CC(=CN6C5=O)C)O)C(=O)OCC7=CC=C(C=C7)NC(=O)[C@H](C)NC(=O)[C@H](C(C)C)NC(=show more
  5. PR-104
    CAS: 851627-62-8 PubChem CID: 11455973 Formula: C14H20BrN4O12PS Molecular Weight: 579.27
    ◐ .Made to order · 8–12 wks Item #: P649370
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    IUPAC Name
    2-[N-(2-bromoethyl)-2,4-dinitro-6-(2-phosphonooxyethylcarbamoyl)anilino]ethyl methanesulfonate
    SMILES
    CS(=O)(=O)OCCN(CCBr)C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)NCCOP(=O)(O)O
    InChIKey
    GZSOKPMDWVRVMG-UHFFFAOYSA-N
    InChI
    1S/C14H20BrN4O12PS/c1-33(28,29)31-7-5-17(4-2-15)13-11(14(20)16-3-6-30-32(25,26)27)8-10(18(21)22)9-12(13)19(23)24/h8-9H,2-7H2,1H3,(H,16,20)(H2,25,26,27show more
    Synonyms
    C14H20BrN4O12PS | V16D2ZT7DT | PR-104/104A | AKOS040755172 | A13988 | PR 104 | ((2-BROMOETHYL)-2,4-DINITRO-6-(((2-(PH...
  6. Duocarmycin DM free base
    CAS: 1116745-06-2 PubChem CID: 56675231 Formula: C26H26ClN3O3 Molecular Weight: 463.96
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥95%
    ◐ .Made to order · 8–12 wks Item #: D649824
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    IUPAC Name
    [(1S)-1-(chloromethyl)-5-hydroxy-1,2-dihydrobenzo[e]indol-3-yl]-[5-[2-(dimethylamino)ethoxy]-1H-indol-2-yl]methanone
    SMILES
    CN(C)CCOC1=CC2=C(C=C1)NC(=C2)C(=O)N3CC(C4=C3C=C(C5=CC=CC=C54)O)CCl
    InChIKey
    JRGWJJXUVWWGDA-QGZVFWFLSA-N
    InChI
    1S/C26H26ClN3O3/c1-29(2)9-10-33-18-7-8-21-16(11-18)12-22(28-21)26(32)30-15-17(14-27)25-20-6-4-3-5-19(20)24(31)13-23(25)30/h3-8,11-13,17,28,31H,9-10,14show more
    Synonyms
    [(1S)-1-(chloromethyl)-5-hydroxy-1,2-dihydrobenzo[e]indol-3-yl]-[5-[2-(dimethylamino)ethoxy]-1H-indol-2-yl]methanone
  7. SJG-136, DNA cross-linking agent
    CAS: 232931-57-6 Formula: C31H32N4O6 Molecular Weight: 556.61
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    ● In Stock — US warehouse, ships to EU* Item #: S650909
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    IUPAC Name
    (6aS)-3-[3-[[(6aS)-2-methoxy-8-methylidene-11-oxo-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]propoxy]-2-methoxy-8-methylidene-7,9-dihydshow more
    SMILES
    COC1=C(C=C2C(=C1)C(=O)N3CC(=C)CC3C=N2)OCCCOC4=C(C=C5C(=C4)N=CC6CC(=C)CN6C5=O)OC
    InChIKey
    RWZVMMQNDHPRQD-SFTDATJTSA-N
    InChI
    1S/C31H32N4O6/c1-18-8-20-14-32-24-12-28(26(38-3)10-22(24)30(36)34(20)16-18)40-6-5-7-41-29-13-25-23(11-27(29)39-4)31(37)35-17-19(2)9-21(35)15-33-25/h10show more
    Synonyms
    SJG 136 [WHO-DD] | (6aS)-3-[3-[[(6aS)-2-methoxy-8-methylidene-11-oxo-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin...
  8. SG2057
    CAS: 260417-62-7 PubChem CID: 9938287 Formula: C33H36N4O6 Molecular Weight: 584.66
    ◐ .Made to order · 8–12 wks Item #: S651259
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    Technical Identifiers
    SMILES
    COC1=C(C=C2C(=C1)C(=O)N3CC(=C)C[C@H]3C=N2)OCCCCCOC4=C(C=C5C(=C4)N=C[C@@H]6CC(=C)CN6C5=O)OC
  9. NCI172112
    CAS: 56605-16-4 PubChem CID: 41945 Formula: C14H23Cl2N3O2 Molecular Weight: 336.26
    ◐ .Made to order · 8–12 wks Item #: N648029
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    Technical Identifiers
    IUPAC Name
    3-[2-[bis(2-chloroethyl)amino]ethyl]-1,3-diazaspiro[4.5]decane-2,4-dione
    SMILES
    C1CCC2(CC1)C(=O)N(C(=O)N2)CCN(CCCl)CCCl
    InChIKey
    QNKJFXARIMSDBR-UHFFFAOYSA-N
    InChI
    1S/C14H23Cl2N3O2/c15-6-8-18(9-7-16)10-11-19-12(20)14(17-13(19)21)4-2-1-3-5-14/h1-11H2,(H,17,21)
    Synonyms
    1,3-Diazaspiro(4.5)decane-2,4-dione, 3-(2-(bis(2-chloroethyl)amino)ethyl)- | 3-[2-[bis(2-chloroethyl)amino]ethyl]-1,3...
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R&D Use Only Products supplied for research and development use

Frequently Asked Questions

Which compounds are listed for DNA Alkylator/Crosslinker?
Compounds associated with DNA Alkylator/Crosslinker are grouped here under the Cell Cycle/DNA Damage classification, with mechanism, structure, and reported potency shown per entry. Use it as a starting shortlist rather than a final selection.
How does DNA Alkylator/Crosslinker sit within Cell Cycle/DNA Damage?
DNA Alkylator/Crosslinker is one target listing within the Cell Cycle/DNA Damage classification. Compounds here may also appear under related targets, so check the selectivity data rather than assuming the annotation is exclusive.
What data should I check before ordering a compound from DNA Alkylator/Crosslinker?
For compounds listed under DNA Alkylator/Crosslinker, check purity — typically 98% or better by HPLC — the reported potency and the assay it was measured in, solubility and recommended stock solvent, and storage and stability. Batch-specific values are given on the Certificate of Analysis. All products are supplied for professional research and development use only, and are not for use in humans, animals, diagnostics, or therapy.
How do I find related targets or backup compounds for DNA Alkylator/Crosslinker?
Browse the parent Cell Cycle/DNA Damage listing to reach targets neighbouring DNA Alkylator/Crosslinker, and use the structure search to find analogs of a compound that worked. Unlisted compounds and bulk quantities: [email protected]. We supply verified businesses, research institutions, universities, and government agencies.

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