N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-phenylpyrimidine-5-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-methylsulfonylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-propan-2-ylsulfonylbenzamide

C82H67Cl4N11O10S3 — CID 157341551

IUPACN-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-phenylpyrimidine-5-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-methylsulfonylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-propan-2-ylsulfonylbenzamide
SMILESCC(C)S(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)cc1.CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)cn1.Cc1cc(S(C)(=O)=O)ccc1C(=O)Nc1ccc(Cl)c(-c2ccccn2)c1.Cc1ncc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(-c2ccccc2)n1
InChIInChI=1S/C23H17ClN4O.C21H19ClN2O3S.C20H17ClN2O3S.C18H14ClN3O3S/c1-15-26-14-19(22(27-15)16-7-3-2-4-8-16)23(29)28-17-10-11-20(24)18(13-17)21-9-5-6-12-25-21;1-14(2)28(26,27)17-9-6-15(7-10-17)21(25)24-16-8-11-19(22)18(13-16)20-5-3-4-12-23-20;1-13-11-15(27(2,25)26)7-8-16(13)20(24)23-14-6-9-18(21)17(12-14)19-5-3-4-10-22-19;1-26(24,25)17-8-5-12(11-21-17)18(23)22-13-6-7-15(19)14(10-13)16-4-2-3-9-20-16/h2-14H,1H3,(H,28,29);3-14H,1-2H3,(H,24,25);3-12H,1-2H3,(H,23,24);2-11H,1H3,(H,22,23)
InChIKeyBGLNRCOFKRKSKT-UHFFFAOYSA-N
MW1604.52 g/mol
LogP18.08
Rot. Bonds17

About N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-phenylpyrimidine-5-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-methylsulfonylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-propan-2-ylsulfonylbenzamide

N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-phenylpyrimidine-5-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-methylsulfonylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-propan-2-ylsulfonylbenzamide (PubChem CID 157341551) has the molecular formula C82H67Cl4N11O10S3 and a molecular weight of 1604.52 g/mol. Its IUPAC name is N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-phenylpyrimidine-5-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-methylsulfonylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-propan-2-ylsulfonylbenzamide.

Molecular Properties

Compound NameN-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-phenylpyrimidine-5-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-methylsulfonylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-propan-2-ylsulfonylbenzamide
PubChem CID157341551
Molecular FormulaC82H67Cl4N11O10S3
Molecular Weight1604.52 g/mol
Exact Mass1601.30
IUPAC NameN-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-phenylpyrimidine-5-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-methylsulfonylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-propan-2-ylsulfonylbenzamide
SMILESCC(C)S(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)cc1.CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)cn1.Cc1cc(S(C)(=O)=O)ccc1C(=O)Nc1ccc(Cl)c(-c2ccccn2)c1.Cc1ncc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(-c2ccccc2)n1
InChIInChI=1S/C23H17ClN4O.C21H19ClN2O3S.C20H17ClN2O3S.C18H14ClN3O3S/c1-15-26-14-19(22(27-15)16-7-3-2-4-8-16)23(29)28-17-10-11-20(24)18(13-17)21-9-5-6-12-25-21;1-14(2)28(26,27)17-9-6-15(7-10-17)21(25)24-16-8-11-19(22)18(13-16)20-5-3-4-12-23-20;1-13-11-15(27(2,25)26)7-8-16(13)20(24)23-14-6-9-18(21)17(12-14)19-5-3-4-10-22-19;1-26(24,25)17-8-5-12(11-21-17)18(23)22-13-6-7-15(19)14(10-13)16-4-2-3-9-20-16/h2-14H,1H3,(H,28,29);3-14H,1-2H3,(H,24,25);3-12H,1-2H3,(H,23,24);2-11H,1H3,(H,22,23)
InChIKeyBGLNRCOFKRKSKT-UHFFFAOYSA-N
XLogP18.08
TPSA309.05 Ų
H-Bond Donors4
H-Bond Acceptors17
Rotatable Bonds17
Heavy Atoms110
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001604.52
LogP ≤ 518.08
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1017

Analyze N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-phenylpyrimidine-5-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-methylsulfonylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-propan-2-ylsulfonylbenzamide with MolForge

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Related Compounds

2-chloro-N-(4-chloro-3-isoquinolin-1-ylphenyl)-5-methylsulfonylbenzamide;N-(4-chloro-3-isoquinolin-1-ylphenyl)-4-(dimethylsulfamoyl)benzamide;N-(4-chloro-3-isoquinolin-1-ylphenyl)-3-methylsulfonylbenzamide;N-(4-chloro-3-isoquinolin-1-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-isoquinolin-1-ylphenyl)-6-(1,2,4-triazol-1-yl)pyridine-3-carboxamide
CID 157637752
N-[4-[(4-chloro-3-pyridinyl)sulfonylmethyl]-3-(trifluoromethyl)phenyl]-4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)methyl]benzamide;N-[4-[(6-chloro-3-pyridinyl)sulfonylmethyl]-3-(trifluoromethyl)phenyl]-4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)methyl]benzamide;4-methyl-N-[6-(2-oxobut-3-enyl)naphthalen-2-yl]-3-[(4-pyridin-3-ylpyrimidin-2-yl)methyl]benzamide;4-methyl-N-(2-prop-2-enoyl-3,4-dihydro-1H-isoquinolin-6-yl)-3-[(4-pyridin-3-ylpyrimidin-2-yl)methyl]benzamide
CID 159047716
4-acetamido-N-(4-chloro-3-isoquinolin-1-ylphenyl)benzamide;4-acetamido-N-(4-chloro-3-quinazolin-4-ylphenyl)benzamide;2-chloro-N-(4-chloro-3-isoquinolin-1-ylphenyl)-4-methylsulfonylbenzamide;N-(4-chloro-3-isoquinolin-1-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 160031814
4-[2-[[2-amino-6-(3-chloro-2-methylphenyl)pyrimidin-4-yl]amino]ethyl]-3-fluorobenzamide;6-[3-[[2-amino-6-(3-chloro-2-methylphenyl)pyrimidin-4-yl]amino]propyl]-1,3,5-triazine-2,4-diamine;2-[3-[2-amino-6-(3-chloro-2-methylphenyl)pyrimidin-4-yl]propylamino]-4-(trifluoromethyl)pyrimidine-5-carboxamide;tert-butyl N-[6-[3-[[2-amino-6-(3-chloro-2-methylphenyl)pyrimidin-4-yl]amino]propyl]-3-pyridinyl]carbamate;4-(3-chloro-2-methylphenyl)-6-[3-(4-methylsulfinylanilino)propyl]pyrimidin-2-amine;6-(3-chloro-2-methylphenyl)-4-N-[3-(4-propan-2-ylsulfonylphenyl)propyl]pyrimidine-2,4-diamine
CID 161373706
5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-hydroxyethylamino)pyridine-3-carboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(methanesulfonamido)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methylsulfonylbenzamide;N-[4-chloro-3-[5-(trifluoromethyl)-2-pyridinyl]phenyl]-4-methylsulfonylbenzamide;N-[4-chloro-3-[5-(trifluoromethyl)-2-pyridinyl]phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 162000054
1-(4-Aminophenyl)-2-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)methyl]phenyl]ethanone;2-chloro-5-chlorylsulfanylpyridine;bis(1-[4-[(6-chloro-3-pyridinyl)sulfonylmethyl]phenyl]-2-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)methyl]phenyl]ethanone)
CID 157274743
2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-fluoropyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3-methylthiophene-2-carboxamide
CID 157329224
4-acetamido-2-chloro-N-(4-methoxy-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;4-acetamido-2-chloro-N-[4-(methylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]benzamide;4-acetamido-2-chloro-N-(4-methylsulfanyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methoxy-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-methylsulfonylbenzamide
CID 157383434
5-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-morpholin-4-ylethylsulfonyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[[(2R)-2-hydroxypropyl]sulfamoyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-methoxyethylamino)-2-methylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide
CID 157566029
N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(dimethylamino)ethylsulfamoyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[3-(dimethylamino)propylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(2-methoxyethylamino)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
CID 157573939
N-[4-(1-aminoethenyl)phenyl]-4-(4-pyridin-2-ylsulfonylphenyl)pyrimidin-2-amine;1-[4-[[4-(4-chlorophenyl)pyrimidin-2-yl]amino]phenyl]ethanone;4-[[6-(4-pyridin-3-ylsulfonylphenyl)-2-pyridinyl]amino]benzamide;4-[[6-(4-pyridin-4-ylsulfonylphenyl)-2-pyridinyl]amino]benzamide
CID 157619675
N-(4-chloro-3-pyridin-2-ylphenyl)-4-(dimethylsulfamoyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylthiophene-2-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-sulfamoylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-(1,2,4-triazol-1-yl)pyridine-3-carboxamide;2,6-dichloro-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide
CID 157772747

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-phenylpyrimidine-5-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-methylsulfonylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-propan-2-ylsulfonylbenzamide?
The IUPAC name of N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-phenylpyrimidine-5-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-methylsulfonylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-propan-2-ylsulfonylbenzamide (CID 157341551) is N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-phenylpyrimidine-5-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-methylsulfonylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-propan-2-ylsulfonylbenzamide.
What is the SMILES notation for N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-phenylpyrimidine-5-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-methylsulfonylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-propan-2-ylsulfonylbenzamide?
The canonical SMILES for N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-phenylpyrimidine-5-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-methylsulfonylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-propan-2-ylsulfonylbenzamide is CC(C)S(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)cc1.CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)cn1.Cc1cc(S(C)(=O)=O)ccc1C(=O)Nc1ccc(Cl)c(-c2ccccn2)c1.Cc1ncc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(-c2ccccc2)n1.
What is the InChIKey of N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-phenylpyrimidine-5-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-methylsulfonylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-propan-2-ylsulfonylbenzamide?
The InChIKey is BGLNRCOFKRKSKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17ClN4O.C21H19ClN2O3S.C20H17ClN2O3S.C18H14ClN3O3S/c1-15-26-14-19(22(27-15)16-7-3-2-4-8-16)23(29)28-17-10-11-20(24)18(13-17)21-9-5-6-12-25-21;1-14(2)28(26,27)17-9-6-15(7-10-17)21(25)24-16-8-11-19(22)18(13-16)20-5-3-4-12-23-20;1-13-11-15(27(2,25)26)7-8-16(13)20(24)23-14-6-9-18(21)17(12-14)19-5-3-4-10-22-19;1-26(24,25)17-8-5-12(11-21-17)18(23)22-13-6-7-15(19)14(10-13)16-4-2-3-9-20-16/h2-14H,1H3,(H,28,29);3-14H,1-2H3,(H,24,25);3-12H,1-2H3,(H,23,24);2-11H,1H3,(H,22,23).
What are the key properties of N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-phenylpyrimidine-5-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-methylsulfonylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-propan-2-ylsulfonylbenzamide?
N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-phenylpyrimidine-5-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-methylsulfonylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-propan-2-ylsulfonylbenzamide has a molecular weight of 1604.52 g/mol, XLogP of 18.08, 17 rotatable bonds, 4 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-4-phenylpyrimidine-5-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-methylsulfonylpyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-propan-2-ylsulfonylbenzamide is sourced from PubChem (CID 157341551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).