6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-chlorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-(4-methylpiperazin-1-yl)benzamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3,5-dimethylpiperazin-1-yl)-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide

C144H137Cl7F6N28O13S — CID 158345271

IUPAC6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-chlorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-(4-methylpiperazin-1-yl)benzamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3,5-dimethylpiperazin-1-yl)-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide
SMILESCC(=O)N1CCN(c2ccc(C(=O)Nc3ccc(Cl)c(NC(=O)c4ccc(Cl)cc4)c3)cn2)CC1.CN1CCN(c2ccc(C(=O)Nc3ccc(Cl)c(NC(=O)c4ccccc4)c3)cc2)CC1.C[C@@H]1CN(c2ccc(C(=O)Nc3ccc(Cl)c(NC(=O)c4cccc(F)c4)c3)cn2)C[C@H](C)N1.Cc1nc(C)c(C(=O)Nc2cc(NC(=O)c3ccc(C(F)(F)F)nc3C)ccc2Cl)s1.Cc1nc(N2CC(C)NC(C)C2)ccc1C(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(F)cc2)c1.O=C(Nc1ccc(Cl)c(NC(=O)c2ccc(F)cc2)c1)c1ccc(N2CCNCC2)nc1
InChIInChI=1S/C26H27ClFN5O2.C25H23Cl2N5O3.C25H25ClFN5O2.C25H25ClN4O2.C23H21ClFN5O2.C20H16ClF3N4O2S/c1-15-13-33(14-16(2)29-15)24-11-9-21(17(3)30-24)26(35)31-20-8-10-22(27)23(12-20)32-25(34)18-4-6-19(28)7-5-18;1-16(33)31-10-12-32(13-11-31)23-9-4-18(15-28-23)25(35)29-20-7-8-21(27)22(14-20)30-24(34)17-2-5-19(26)6-3-17;1-15-13-32(14-16(2)29-15)23-9-6-18(12-28-23)25(34)30-20-7-8-21(26)22(11-20)31-24(33)17-4-3-5-19(27)10-17;1-29-13-15-30(16-14-29)21-10-7-19(8-11-21)24(31)27-20-9-12-22(26)23(17-20)28-25(32)18-5-3-2-4-6-18;24-19-7-6-18(13-20(19)29-22(31)15-1-4-17(25)5-2-15)28-23(32)16-3-8-21(27-14-16)30-11-9-26-10-12-30;1-9-13(5-7-16(26-9)20(22,23)24)18(29)27-12-4-6-14(21)15(8-12)28-19(30)17-10(2)25-11(3)31-17/h4-12,15-16,29H,13-14H2,1-3H3,(H,31,35)(H,32,34);2-9,14-15H,10-13H2,1H3,(H,29,35)(H,30,34);3-12,15-16,29H,13-14H2,1-2H3,(H,30,34)(H,31,33);2-12,17H,13-16H2,1H3,(H,27,31)(H,28,32);1-8,13-14,26H,9-12H2,(H,28,32)(H,29,31);4-8H,1-3H3,(H,27,29)(H,28,30)/t;;15-,16+;;;
InChIKeyGRQRPBRPOJFABQ-YETUJFGFSA-N
MW2862.09 g/mol
LogP28.03
Rot. Bonds29

About 6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-chlorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-(4-methylpiperazin-1-yl)benzamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3,5-dimethylpiperazin-1-yl)-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide

6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-chlorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-(4-methylpiperazin-1-yl)benzamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3,5-dimethylpiperazin-1-yl)-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide (PubChem CID 158345271) has the molecular formula C144H137Cl7F6N28O13S and a molecular weight of 2862.09 g/mol. Its IUPAC name is 6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-chlorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-(4-methylpiperazin-1-yl)benzamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3,5-dimethylpiperazin-1-yl)-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-chlorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-(4-methylpiperazin-1-yl)benzamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3,5-dimethylpiperazin-1-yl)-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide
PubChem CID158345271
Molecular FormulaC144H137Cl7F6N28O13S
Molecular Weight2862.09 g/mol
Exact Mass2856.84
IUPAC Name6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-chlorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-(4-methylpiperazin-1-yl)benzamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3,5-dimethylpiperazin-1-yl)-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide
SMILESCC(=O)N1CCN(c2ccc(C(=O)Nc3ccc(Cl)c(NC(=O)c4ccc(Cl)cc4)c3)cn2)CC1.CN1CCN(c2ccc(C(=O)Nc3ccc(Cl)c(NC(=O)c4ccccc4)c3)cc2)CC1.C[C@@H]1CN(c2ccc(C(=O)Nc3ccc(Cl)c(NC(=O)c4cccc(F)c4)c3)cn2)C[C@H](C)N1.Cc1nc(C)c(C(=O)Nc2cc(NC(=O)c3ccc(C(F)(F)F)nc3C)ccc2Cl)s1.Cc1nc(N2CC(C)NC(C)C2)ccc1C(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(F)cc2)c1.O=C(Nc1ccc(Cl)c(NC(=O)c2ccc(F)cc2)c1)c1ccc(N2CCNCC2)nc1
InChIInChI=1S/C26H27ClFN5O2.C25H23Cl2N5O3.C25H25ClFN5O2.C25H25ClN4O2.C23H21ClFN5O2.C20H16ClF3N4O2S/c1-15-13-33(14-16(2)29-15)24-11-9-21(17(3)30-24)26(35)31-20-8-10-22(27)23(12-20)32-25(34)18-4-6-19(28)7-5-18;1-16(33)31-10-12-32(13-11-31)23-9-4-18(15-28-23)25(35)29-20-7-8-21(27)22(14-20)30-24(34)17-2-5-19(26)6-3-17;1-15-13-32(14-16(2)29-15)23-9-6-18(12-28-23)25(34)30-20-7-8-21(26)22(11-20)31-24(33)17-4-3-5-19(27)10-17;1-29-13-15-30(16-14-29)21-10-7-19(8-11-21)24(31)27-20-9-12-22(26)23(17-20)28-25(32)18-5-3-2-4-6-18;24-19-7-6-18(13-20(19)29-22(31)15-1-4-17(25)5-2-15)28-23(32)16-3-8-21(27-14-16)30-11-9-26-10-12-30;1-9-13(5-7-16(26-9)20(22,23)24)18(29)27-12-4-6-14(21)15(8-12)28-19(30)17-10(2)25-11(3)31-17/h4-12,15-16,29H,13-14H2,1-3H3,(H,31,35)(H,32,34);2-9,14-15H,10-13H2,1H3,(H,29,35)(H,30,34);3-12,15-16,29H,13-14H2,1-2H3,(H,30,34)(H,31,33);2-12,17H,13-16H2,1H3,(H,27,31)(H,28,32);1-8,13-14,26H,9-12H2,(H,28,32)(H,29,31);4-8H,1-3H3,(H,27,29)(H,28,30)/t;;15-,16+;;;
InChIKeyGRQRPBRPOJFABQ-YETUJFGFSA-N
XLogP28.03
TPSA502.38 Ų
H-Bond Donors15
H-Bond Acceptors29
Rotatable Bonds29
Heavy Atoms199
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002862.09
LogP ≤ 528.03
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1029

Analyze 6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-chlorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-(4-methylpiperazin-1-yl)benzamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3,5-dimethylpiperazin-1-yl)-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide with MolForge

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Related Compounds

N-[4-chloro-3-[methyl(pyrimidin-5-yl)amino]phenyl]-6-methylpyridine-2-carboxamide;6-(1,1-difluoroethyl)-N-[4-fluoro-3-[methyl(pyrimidin-5-yl)amino]phenyl]pyridine-2-carboxamide;N-[4-fluoro-3-[methyl(pyrimidin-5-yl)amino]phenyl]-4-methylpyridine-2-carboxamide;bis(N-[4-fluoro-3-[methyl(pyrimidin-5-yl)amino]phenyl]-6-methylpyridine-2-carboxamide);N-[4-fluoro-3-[methyl(pyrimidin-5-yl)amino]phenyl]-1,3-thiazole-4-carboxamide
CID 123153030
6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[4-chloro-3-[(3-chlorobenzoyl)amino]phenyl]-6-[4-(2-hydroxyethyl)piperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(3-chlorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[4-chloro-3-[[4-(thiadiazol-4-yl)benzoyl]amino]phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 157363181
N-[4-chloro-3-[methyl(pyrimidin-5-yl)amino]phenyl]-6-methylpyridine-2-carboxamide;6-(1,1-difluoroethyl)-N-[4-fluoro-3-[methyl(pyrimidin-5-yl)amino]phenyl]pyridine-2-carboxamide;N-[4-fluoro-3-[methyl(pyrimidin-5-yl)amino]phenyl]-4-methylpyridine-2-carboxamide;bis(N-[4-fluoro-3-[methyl(pyrimidin-5-yl)amino]phenyl]-6-methylpyridine-2-carboxamide);N-[4-fluoro-3-[methyl(pyrimidin-5-yl)amino]phenyl]-1,3-thiazole-4-carboxamide;methane
CID 157682480
6-(4-acetylpiperazin-1-yl)-N-(3-benzamido-4-chlorophenyl)pyridine-3-carboxamide;6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-(pyridine-4-carbonylamino)phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-6-(3-methylpiperazin-1-yl)pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-6-(morpholin-4-ylmethyl)pyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[4-chloro-3-[(2-morpholin-4-ylbenzoyl)amino]phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 159763280
N-(3-benzamido-4-chlorophenyl)-6-[(3S,5R)-3,5-dimethylpiperazin-1-yl]-2-methylpyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-6-[4-(2-hydroxyethyl)piperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-[4-(cyclopropanecarbonyl)piperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-[4-(3-methylbutanoyl)piperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 159820358
N-(3-benzamido-4-chlorophenyl)-6-(4-ethylpiperazin-1-yl)pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-6-piperazin-1-ylpyridine-3-carboxamide;N-[4-chloro-3-[(3-chlorobenzoyl)amino]phenyl]-6-[(3S,5R)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;6-chloro-N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-[4-chloro-3-[(3,4-difluorobenzoyl)amino]phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[4-chloro-3-(pyridine-2-carbonylamino)phenyl]-6-[(3S,5R)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide
CID 160393503
N-[4-chloro-3-[(3-chlorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(2-fluorobenzoyl)amino]phenyl]-6-(4-hydroxypiperidin-1-yl)pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3-methylpiperazin-1-yl)pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-[(3R)-3-methylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[[4-(4-methylpiperazin-1-yl)benzoyl]amino]phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-4-propan-2-ylthiadiazole-5-carboxamide
CID 161689000
N-[3-chloro-5-[methyl(pyrimidin-5-yl)amino]phenyl]-3-ethynylbenzamide;bis(N-[2-chloro-5-[methyl(pyrimidin-5-yl)amino]phenyl]-3-methylbenzamide);N-[4-fluoro-3-[methyl(pyrimidin-5-yl)amino]phenyl]-6-methylpyridine-2-carboxamide;N-[4-fluoro-3-[methyl(pyrimidin-5-yl)amino]phenyl]-1,3-thiazole-4-carboxamide
CID 157422452
magnesium;N-(5-acetyl-2-pyridinyl)-2,6-difluorobenzamide;1-(6-amino-3-pyridinyl)ethanone;6-[(2,6-difluorobenzoyl)amino]-N-methoxy-N-methylpyridine-3-carboxamide;2,6-difluorobenzoyl chloride;2,6-difluoro-N-[5-(5-methyl-2-pyridin-2-yl-1,3-thiazol-4-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-(5-propanoyl-2-pyridinyl)benzamide;ethane;bromide
CID 158035681
6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-(pyridine-3-carbonylamino)phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-2-phenyl-1,3-thiazole-4-carboxamide;N-[4-chloro-3-[(3-chlorobenzoyl)amino]phenyl]-6-[[(3S,5R)-3,5-dimethylpiperazin-1-yl]methyl]pyridine-3-carboxamide;6-chloro-N-[4-chloro-3-[(3-chlorobenzoyl)amino]phenyl]-2-methylpyridine-3-carboxamide;6-chloro-N-[4-chloro-3-[(2-fluorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-[4-chloro-3-[(2-fluorobenzoyl)amino]phenyl]-6-[(3S,5R)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide
CID 158908290
magnesium;N-(5-acetyl-2-pyridinyl)-2,6-difluorobenzamide;1-(6-amino-3-pyridinyl)ethanone;6-[(2,6-difluorobenzoyl)amino]-N-methoxy-N-methylpyridine-3-carboxamide;2,6-difluorobenzoyl chloride;2,6-difluoro-N-[5-(5-methyl-2-pyridin-3-yl-1,3-thiazol-4-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-(5-propanoyl-2-pyridinyl)benzamide;ethane;methane;bromide
CID 159225205
magnesium;N-(5-acetyl-2-pyridinyl)-2,6-difluorobenzamide;1-(6-amino-3-pyridinyl)ethanone;6-[(2,6-difluorobenzoyl)amino]-N-methoxy-N-methylpyridine-3-carboxamide;2,6-difluorobenzoyl chloride;2,6-difluoro-N-[5-(5-methyl-2-pyridin-2-yl-1,3-thiazol-4-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-(5-propanoyl-2-pyridinyl)benzamide;ethane;methane;bromide
CID 161844461

Frequently Asked Questions

What is the IUPAC name of 6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-chlorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-(4-methylpiperazin-1-yl)benzamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3,5-dimethylpiperazin-1-yl)-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-chlorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-(4-methylpiperazin-1-yl)benzamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3,5-dimethylpiperazin-1-yl)-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide (CID 158345271) is 6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-chlorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-(4-methylpiperazin-1-yl)benzamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3,5-dimethylpiperazin-1-yl)-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-chlorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-(4-methylpiperazin-1-yl)benzamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3,5-dimethylpiperazin-1-yl)-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-chlorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-(4-methylpiperazin-1-yl)benzamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3,5-dimethylpiperazin-1-yl)-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide is CC(=O)N1CCN(c2ccc(C(=O)Nc3ccc(Cl)c(NC(=O)c4ccc(Cl)cc4)c3)cn2)CC1.CN1CCN(c2ccc(C(=O)Nc3ccc(Cl)c(NC(=O)c4ccccc4)c3)cc2)CC1.C[C@@H]1CN(c2ccc(C(=O)Nc3ccc(Cl)c(NC(=O)c4cccc(F)c4)c3)cn2)C[C@H](C)N1.Cc1nc(C)c(C(=O)Nc2cc(NC(=O)c3ccc(C(F)(F)F)nc3C)ccc2Cl)s1.Cc1nc(N2CC(C)NC(C)C2)ccc1C(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(F)cc2)c1.O=C(Nc1ccc(Cl)c(NC(=O)c2ccc(F)cc2)c1)c1ccc(N2CCNCC2)nc1.
What is the InChIKey of 6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-chlorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-(4-methylpiperazin-1-yl)benzamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3,5-dimethylpiperazin-1-yl)-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide?
The InChIKey is GRQRPBRPOJFABQ-YETUJFGFSA-N. The full InChI is InChI=1S/C26H27ClFN5O2.C25H23Cl2N5O3.C25H25ClFN5O2.C25H25ClN4O2.C23H21ClFN5O2.C20H16ClF3N4O2S/c1-15-13-33(14-16(2)29-15)24-11-9-21(17(3)30-24)26(35)31-20-8-10-22(27)23(12-20)32-25(34)18-4-6-19(28)7-5-18;1-16(33)31-10-12-32(13-11-31)23-9-4-18(15-28-23)25(35)29-20-7-8-21(27)22(14-20)30-24(34)17-2-5-19(26)6-3-17;1-15-13-32(14-16(2)29-15)23-9-6-18(12-28-23)25(34)30-20-7-8-21(26)22(11-20)31-24(33)17-4-3-5-19(27)10-17;1-29-13-15-30(16-14-29)21-10-7-19(8-11-21)24(31)27-20-9-12-22(26)23(17-20)28-25(32)18-5-3-2-4-6-18;24-19-7-6-18(13-20(19)29-22(31)15-1-4-17(25)5-2-15)28-23(32)16-3-8-21(27-14-16)30-11-9-26-10-12-30;1-9-13(5-7-16(26-9)20(22,23)24)18(29)27-12-4-6-14(21)15(8-12)28-19(30)17-10(2)25-11(3)31-17/h4-12,15-16,29H,13-14H2,1-3H3,(H,31,35)(H,32,34);2-9,14-15H,10-13H2,1H3,(H,29,35)(H,30,34);3-12,15-16,29H,13-14H2,1-2H3,(H,30,34)(H,31,33);2-12,17H,13-16H2,1H3,(H,27,31)(H,28,32);1-8,13-14,26H,9-12H2,(H,28,32)(H,29,31);4-8H,1-3H3,(H,27,29)(H,28,30)/t;;15-,16+;;;.
What are the key properties of 6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-chlorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-(4-methylpiperazin-1-yl)benzamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3,5-dimethylpiperazin-1-yl)-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide?
6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-chlorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-(4-methylpiperazin-1-yl)benzamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3,5-dimethylpiperazin-1-yl)-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide has a molecular weight of 2862.09 g/mol, XLogP of 28.03, 29 rotatable bonds, 15 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-acetylpiperazin-1-yl)-N-[4-chloro-3-[(4-chlorobenzoyl)amino]phenyl]pyridine-3-carboxamide;N-(3-benzamido-4-chlorophenyl)-4-(4-methylpiperazin-1-yl)benzamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-(3,5-dimethylpiperazin-1-yl)-2-methylpyridine-3-carboxamide;N-[4-chloro-3-[(3-fluorobenzoyl)amino]phenyl]-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridine-3-carboxamide;N-[4-chloro-3-[(4-fluorobenzoyl)amino]phenyl]-6-piperazin-1-ylpyridine-3-carboxamide;N-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 158345271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).