Pyridopyrimidines

Description:

Compounds containing a pyridopyrimidine, which consists of a pyridine fused to a pyrimidine. Pyridine is 6-membered ring consisting of five carbon atoms and a nitrogen atom. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.

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  1. Dicloromezotiaz
    CAS: 1263629-39-5 Formula: C19H12Cl3N3O2S Molecular Weight: 452.700
    Out of Stock Item #: D964253
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    IUPAC Name
    1-[(2-chloro-1,3-thiazol-5-yl)methyl]-3-(3,5-dichlorophenyl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-1-ium-2-olate
    SMILES
    CC1=CC=CN2C1=[N+](C(=C(C2=O)C3=CC(=CC(=C3)Cl)Cl)[O-])CC4=CN=C(S4)Cl
    InChIKey
    PVDQXPBKBSCNJZ-UHFFFAOYSA-N
    InChI
    1S/C19H12Cl3N3O2S/c1-10-3-2-4-24-16(10)25(9-14-8-23-19(22)28-14)18(27)15(17(24)26)11-5-12(20)7-13(21)6-11/h2-8H,9H2,1H3
  2. SPOP-IN-6b
    CAS: 2136270-20-5 PubChem CID: 127244279
    Out of Stock Item #: S1277810
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    IUPAC Name
    6-imino-11-methyl-N-(3-morpholin-4-ylpropyl)-2-oxo-7-(2-phenylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
    SMILES
    CC1=CC=CN2C1=NC3=C(C2=O)C=C(C(=N)N3CCC4=CC=CC=C4)C(=O)NCCCN5CCOCC5
    InChIKey
    RYTGHNMOSCSWJT-UHFFFAOYSA-N
    InChI
    1S/C28H32N6O3/c1-20-7-5-13-34-25(20)31-26-23(28(34)36)19-22(24(29)33(26)14-10-21-8-3-2-4-9-21)27(35)30-11-6-12-32-15-17-37-18-16-32/h2-5,7-9,13,19,29Hshow more
  3. Leniolisib Phosphate
    CAS: 1354691-97-6 Formula: C21H28F3N6O6P Molecular Weight: 548.5
    Out of Stock Item #: L1240000
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    IUPAC Name
    1-[(3S)-3-[[6-[6-methoxy-5-(trifluoromethyl)pyridin-3-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]amino]pyrrolidin-1-yl]propan-1-one;phosphoric acishow more
    SMILES
    CCC(=O)N1CC[C@@H](C1)NC2=NC=NC3=C2CN(CC3)C4=CC(=C(N=C4)OC)C(F)(F)F.OP(=O)(O)O
    InChIKey
    XXEDEGOAYSGNPS-ZOWNYOTGSA-N
    InChI
    1S/C21H25F3N6O2.H3O4P/c1-3-18(31)30-6-4-13(10-30)28-19-15-11-29(7-5-17(15)26-12-27-19)14-8-16(21(22,23)24)20(32-2)25-9-14;1-5(2,3)4/h8-9,12-13H,3-7,10show more
  4. tert-Butyl 2-(methylthio)-5,6-dihydropyrido[3,4-d]pyrimidine-7(8H)-carboxylate
    CAS: 1226776-86-8 PubChem CID: 54579856 Formula: C13H19N3O2S Molecular Weight: 281.38
    Solid ≥98%
    Out of Stock Item #: T768613
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    IUPAC Name
    tert-butyl 2-methylsulfanyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine-7-carboxylate
    SMILES
    CC(C)(C)OC(=O)N1CCC2=CN=C(N=C2C1)SC
    InChIKey
    MIFDGRIXSGMZSV-UHFFFAOYSA-N
    InChI
    1S/C13H19N3O2S/c1-13(2,3)18-12(17)16-6-5-9-7-14-11(19-4)15-10(9)8-16/h7H,5-6,8H2,1-4H3
  5. AZD6482 (S-isomer)
    CAS: 1173900-37-2 PubChem CID: 57789333
    Out of Stock Item #: A769969
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    IUPAC Name
    2-[[(1S)-1-(7-methyl-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)ethyl]amino]benzoic acid
    SMILES
    CC1=CN2C(=O)C=C(N=C2C(=C1)C(C)NC3=CC=CC=C3C(=O)O)N4CCOCC4
    InChIKey
    IRTDIKMSKMREGO-HNNXBMFYSA-N
    InChI
    1S/C22H24N4O4/c1-14-11-17(15(2)23-18-6-4-3-5-16(18)22(28)29)21-24-19(12-20(27)26(21)13-14)25-7-9-30-10-8-25/h3-6,11-13,15,23H,7-10H2,1-2H3,(H,28,29)/tshow more
  6. Paliperidone-d4
    CAS: 1020719-55-4 EC Number: 200-659-6 Formula: C23D4H23FN4O3 Molecular Weight: 430.51
    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 atom% D,≥98%(CP)
    In Stock Item #: P757620
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    IUPAC Name
    9-hydroxy-2-methyl-3-[1,1,2,2-tetradeuterio-2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
    SMILES
    CC1=C(C(=O)N2CCCC(C2=N1)O)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F
    InChIKey
    PMXMIIMHBWHSKN-FJVJJXCISA-N
    InChI
    1S/C23H27FN4O3/c1-14-17(23(30)28-9-2-3-19(29)22(28)25-14)8-12-27-10-6-15(7-11-27)21-18-5-4-16(24)13-20(18)31-26-21/h4-5,13,15,19,29H,2-3,6-12H2,1H3/i8show more
  7. 2-(Methylthio)-5,6,7,8-tetrahydropyrido[3,2-d]pyrimidine Hydrochloride
    CAS: 1375064-63-3 PubChem CID: 71432792 Formula: C8H12ClN3S Molecular Weight: 217.72
    Out of Stock Item #: T734925
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    Technical Identifiers
    IUPAC Name
    2-methylsulfanyl-5,6,7,8-tetrahydropyrido[3,2-d]pyrimidine;hydrochloride
    SMILES
    CSC1=NC=C2C(=N1)CCCN2.Cl
    InChIKey
    MPUMFJCLDZVTGY-UHFFFAOYSA-N
    InChI
    1S/C8H11N3S.ClH/c1-12-8-10-5-7-6(11-8)3-2-4-9-7;/h5,9H,2-4H2,1H3;1H
  8. 2-(Methylthio)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine Hydrochloride
    CAS: 1226776-81-3 PubChem CID: 54579857 Formula: C8H12ClN3S Molecular Weight: 217.72
    Out of Stock Item #: T733822
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    IUPAC Name
    2-methylsulfanyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine;hydrochloride
    SMILES
    CSC1=NC=C2CCNCC2=N1.Cl
    InChIKey
    YFKALMFJNBJAGK-UHFFFAOYSA-N
    InChI
    1S/C8H11N3S.ClH/c1-12-8-10-4-6-2-3-9-5-7(6)11-8;/h4,9H,2-3,5H2,1H3;1H
  9. tert-Butyl 2-methoxy-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxylate
    CAS: 900156-22-1 PubChem CID: 49758029 Formula: C13H19N3O3 Molecular Weight: 265.31
    Out of Stock Item #: T732958
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    IUPAC Name
    tert-butyl 2-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylate
    SMILES
    CC(C)(C)OC(=O)N1CCC2=NC(=NC=C2C1)OC
    InChIKey
    ZCQWTDGQUOIOEF-UHFFFAOYSA-N
    InChI
    1S/C13H19N3O3/c1-13(2,3)19-12(17)16-6-5-10-9(8-16)7-14-11(15-10)18-4/h7H,5-6,8H2,1-4H3
  10. tert-Butyl 2-methyl-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxylate
    CAS: 210538-72-0 PubChem CID: 69223447
    Out of Stock Item #: T734738
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    Technical Identifiers
    IUPAC Name
    tert-butyl 2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylate
    SMILES
    CC1=NC=C2CN(CCC2=N1)C(=O)OC(C)(C)C
    InChIKey
    MFFOVBHZCZAHIG-UHFFFAOYSA-N
    InChI
    1S/C13H19N3O2/c1-9-14-7-10-8-16(6-5-11(10)15-9)12(17)18-13(2,3)4/h7H,5-6,8H2,1-4H3
  11. Ethyl 2-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-yl)acetate hydrochloride
    CAS: 1187830-78-9 PubChem CID: 56777004 Formula: C11H16ClN3O2 Molecular Weight: 257.72
    Out of Stock Item #: E734004
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    IUPAC Name
    ethyl 2-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-yl)acetate;hydrochloride
    SMILES
    CCOC(=O)CC1=NC=NC2=C1CNCC2.Cl
    InChIKey
    BLTIZFCRGSQQEN-UHFFFAOYSA-N
    InChI
    1S/C11H15N3O2.ClH/c1-2-16-11(15)5-10-8-6-12-4-3-9(8)13-7-14-10;/h7,12H,2-6H2,1H3;1H
  12. 9-(Benzyloxy)-3-(2-Hydroxyethyl)-2-Methyl-4H-Pyrido[1,2-A]Pyrimidin-4-One
    CAS: 1008796-22-2 PubChem CID: 24898515 Formula: C18H18N2O3 Molecular Weight: 310.35
    Out of Stock Item #: M731441
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    IUPAC Name
    3-(2-hydroxyethyl)-2-methyl-9-phenylmethoxypyrido[1,2-a]pyrimidin-4-one
    SMILES
    CC1=C(C(=O)N2C=CC=C(C2=N1)OCC3=CC=CC=C3)CCO
    InChIKey
    AYNDDJMEHBUOGI-UHFFFAOYSA-N
    InChI
    1S/C18H18N2O3/c1-13-15(9-11-21)18(22)20-10-5-8-16(17(20)19-13)23-12-14-6-3-2-4-7-14/h2-8,10,21H,9,11-12H2,1H3
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