Halobenzoic acids and derivatives

Description:

Benzoic acids or derivatives carrying a halogen atom on the benzene ring.

Ancestors:

Organic compounds ⮕ Benzenoids ⮕ Benzene and substituted derivatives ⮕ Benzoic acids and derivatives ⮕ Halobenzoic acids and derivatives

Popular Products

GSK3beta Inhibitor XVIII
CAS: 1139875-74-3 Formula: C₂₀H₂₀ClN₅OS Molecular Weight: 413.900

≥99%

Out of Stock Item #: G972003

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IUPAC Name

[2-chloro-4-[(4-thiophen-2-ylpyrimidin-2-yl)amino]phenyl]-(4-methylpiperazin-1-yl)methanone

SMILES

CN1CCN(CC1)C(=O)C2=C(C=C(C=C2)NC3=NC=CC(=N3)C4=CC=CS4)Cl

InChIKey
CLDIUVXCUVQLGD-UHFFFAOYSA-N

InChI

1S/C20H20ClN5OS/c1-25-8-10-26(11-9-25)19(27)15-5-4-14(13-16(15)21)23-20-22-7-6-17(24-20)18-3-2-12-28-18/h2-7,12-13H,8-11H2,1H3,(H,22,23,24)
Ioxitalamic Acid
CAS: 28179-44-4 EC Number: 248-887-5 PubChem CID: 34536 Formula: C₁₂H₁₁I₃N₂O₅ Molecular Weight: 643.95

Out of Stock Item #: I1073669

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IUPAC Name

3-acetamido-5-(2-hydroxyethylcarbamoyl)-2,4,6-triiodobenzoic acid

SMILES

CC(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)NCCO)I

InChIKey
OLAOYPRJVHUHCF-UHFFFAOYSA-N

InChI

1S/C12H11I3N2O5/c1-4(19)17-10-8(14)5(11(20)16-2-3-18)7(13)6(9(10)15)12(21)22/h18H,2-3H2,1H3,(H,16,20)(H,17,19)(H,21,22)
AT7519 trifluoroacetate
CAS: 1431697-85-6 PubChem CID: 71576690

≥98%

Out of Stock Item #: A1324780

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IUPAC Name

4-[(2,6-dichlorobenzoyl)amino]-N-piperidin-4-yl-1H-pyrazole-5-carboxamide;2,2,2-trifluoroacetic acid

SMILES

C1CNCCC1NC(=O)C2=C(C=NN2)NC(=O)C3=C(C=CC=C3Cl)Cl.C(=O)(C(F)(F)F)O

InChIKey
XTOQTRBZWZONHQ-UHFFFAOYSA-N

InChI

1S/C16H17Cl2N5O2.C2HF3O2/c17-10-2-1-3-11(18)13(10)15(24)22-12-8-20-23-14(12)16(25)21-9-4-6-19-7-5-9;3-2(4,5)1(6)7/h1-3,8-9,19H,4-7H2,(H,20,23)(H,21,25show more
3,5-dichloro-N-((1-((2,2-dimethyltetrahydro-2H-pyran-4-yl)methyl)-4-fluoropiperidin-4-yl)methyl)benzamide
CAS: 918430-49-6 PubChem CID: 16005493 Formula: C₂₁H₂₉Cl₂FN₂O₂ Molecular Weight: 431.4

≥98%

Out of Stock Item #: D1359432

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IUPAC Name

3,5-dichloro-N-[[1-[(2,2-dimethyloxan-4-yl)methyl]-4-fluoropiperidin-4-yl]methyl]benzamide

SMILES

CC1(CC(CCO1)CN2CCC(CC2)(CNC(=O)C3=CC(=CC(=C3)Cl)Cl)F)C

InChIKey
DKNDOKIVCXTFHJ-UHFFFAOYSA-N

InChI

1S/C21H29Cl2FN2O2/c1-20(2)12-15(3-8-28-20)13-26-6-4-21(24,5-7-26)14-25-19(27)16-9-17(22)11-18(23)10-16/h9-11,15H,3-8,12-14H2,1-2H3,(H,25,27)
4-Chlorobenzoic Acid-d4
CAS: 85577-25-9 PubChem CID: 12203308 Formula: C₇HD₄ClO₂ Molecular Weight: 160.59

Out of Stock Item #: C1231878

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IUPAC Name

4-chloro-2,3,5,6-tetradeuteriobenzoic acid

SMILES

C1=CC(=CC=C1C(=O)O)Cl

InChIKey
XRHGYUZYPHTUJZ-RHQRLBAQSA-N

InChI

1S/C7H5ClO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)/i1D,2D,3D,4D
2-bromo-N-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)benzamide
CAS: 302939-48-6 PubChem CID: 1330855

≥98%

Out of Stock Item #: B1035290

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IUPAC Name

2-bromo-N-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)benzamide

SMILES

C1CCC2=C(C1)C3=C(N=CN=C3S2)NC(=O)C4=CC=CC=C4Br

InChIKey
KFSLRFWIPVMBNT-UHFFFAOYSA-N

InChI

1S/C17H14BrN3OS/c18-12-7-3-1-5-10(12)16(22)21-15-14-11-6-2-4-8-13(11)23-17(14)20-9-19-15/h1,3,5,7,9H,2,4,6,8H2,(H,19,20,21,22)
Parimifasor
CAS: 1796641-10-5 Formula: C₁₈H₁₁Cl₂F₄N₅O Molecular Weight: 460.2

≥98%

Out of Stock Item #: P1321105

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IUPAC Name

3-chloro-N-[N-(3-chloro-5-fluorophenyl)-N'-[5-(trifluoromethyl)-1H-pyrazol-3-yl]carbamimidoyl]benzamide

SMILES

C1=CC(=CC(=C1)Cl)C(=O)NC(=NC2=NNC(=C2)C(F)(F)F)NC3=CC(=CC(=C3)Cl)F

InChIKey
GPLAWHGEODGIAW-UHFFFAOYSA-N

InChI

1S/C18H11Cl2F4N5O/c19-10-3-1-2-9(4-10)16(30)27-17(25-13-6-11(20)5-12(21)7-13)26-15-8-14(28-29-15)18(22,23)24/h1-8H,(H3,25,26,27,28,29,30)
PC-190723
CAS: 951120-33-5 PubChem CID: 25016417 Formula: C₁₄H₈ClF₂N₃O₂S Molecular Weight: 355.75

Solid Moligand™ ? ≥98%

Out of Stock Item #: P1064469

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IUPAC Name

3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide

SMILES

C1=CC(=C(C(=C1OCC2=NC3=C(S2)N=CC(=C3)Cl)F)C(=O)N)F

InChIKey
INYJNSBDHOVLAH-UHFFFAOYSA-N

InChI

1S/C14H8ClF2N3O2S/c15-6-3-8-14(19-4-6)23-10(20-8)5-22-9-2-1-7(16)11(12(9)17)13(18)21/h1-4H,5H2,(H2,18,21)

Synonyms
3-((6-Chlorothiazolo[5,4-b]pyridin-2-yl)methoxy)-2,6-difluorobenzamide | PC190723 | PC 190723
FK-960
CAS: 133920-70-4 PubChem CID: 181428 Formula: C₁₃H₁₆FN₃O₂ Molecular Weight: 265.28

Out of Stock Item #: F1059397

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IUPAC Name

N-(4-acetylpiperazin-1-yl)-4-fluorobenzamide

SMILES

CC(=O)N1CCN(CC1)NC(=O)C2=CC=C(C=C2)F

InChIKey
XTOKQKWTUYYVAO-UHFFFAOYSA-N

InChI

1S/C13H16FN3O2/c1-10(18)16-6-8-17(9-7-16)15-13(19)11-2-4-12(14)5-3-11/h2-5H,6-9H2,1H3,(H,15,19)
FR167356
CAS: 174185-16-1 Formula: C₁₉H₁₇Cl₂NO₃ Molecular Weight: 378.200

Out of Stock Item #: F1030561

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IUPAC Name

2,6-dichloro-N-[3-(2-hydroxypropan-2-yl)-2-methyl-1-benzofuran-7-yl]benzamide

SMILES

CC1=C(C2=C(O1)C(=CC=C2)NC(=O)C3=C(C=CC=C3Cl)Cl)C(C)(C)O

InChIKey
GCAOVMKRBUCSET-UHFFFAOYSA-N

InChI

1S/C19H17Cl2NO3/c1-10-16(19(2,3)24)11-6-4-9-14(17(11)25-10)22-18(23)15-12(20)7-5-8-13(15)21/h4-9,24H,1-3H3,(H,22,23)
EBV lytic cycle inducer-1
CAS: 394668-43-0 Formula: C₁₄H₁₂BrN₃O Molecular Weight: 318.17

≥98%

Out of Stock Item #: E1240319

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IUPAC Name

3-bromo-N-[(E)-1-pyridin-2-ylethylideneamino]benzamide

SMILES

C/C(=N\NC(=O)C1=CC(=CC=C1)Br)/C2=CC=CC=N2

InChIKey
GZJPBATWGXWPLE-LICLKQGHSA-N

InChI

1S/C14H12BrN3O/c1-10(13-7-2-3-8-16-13)17-18-14(19)11-5-4-6-12(15)9-11/h2-9H,1H3,(H,18,19)/b17-10+
2，4，6-triiodobenzene-1，3，5-tricarboxylic acid
CAS: 79211-41-9 PubChem CID: 133178 Formula: C₉H₃I₃O₆ Molecular Weight: 587.83

≥98%

Out of Stock Item #: T768955

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IUPAC Name

2,4,6-triiodobenzene-1,3,5-tricarboxylic acid

SMILES

C1(=C(C(=C(C(=C1I)C(=O)O)I)C(=O)O)I)C(=O)O

InChIKey
YLJAKJSGUDBOHG-UHFFFAOYSA-N

InChI

1S/C9H3I3O6/c10-4-1(7(13)14)5(11)3(9(17)18)6(12)2(4)8(15)16/h(H,13,14)(H,15,16)(H,17,18)

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