2-(1-benzylsulfonylpyrrol-3-yl)-1-(6-methyl-2-pyridinyl)ethanone;2-(1-benzylsulfonylpyrrol-3-yl)-1-(1,3-thiazol-2-yl)ethanone;2-[1-(2-chlorophenyl)sulfonylpyrrol-3-yl]-1-phenylethanone;N-[1-(3-chlorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-cyanophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(difluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(4-fluorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-methylphenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(2-methylpropyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(trifluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide

C173H143Cl2F6N27O32S11 — CID 160590747

IUPAC2-(1-benzylsulfonylpyrrol-3-yl)-1-(6-methyl-2-pyridinyl)ethanone;2-(1-benzylsulfonylpyrrol-3-yl)-1-(1,3-thiazol-2-yl)ethanone;2-[1-(2-chlorophenyl)sulfonylpyrrol-3-yl]-1-phenylethanone;N-[1-(3-chlorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-cyanophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(difluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(4-fluorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-methylphenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(2-methylpropyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(trifluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide
SMILESCC(C)Cc1ccc(S(=O)(=O)n2ccc(NC(=O)c3ccccn3)c2)cc1.Cc1cccc(C(=O)Cc2ccn(S(=O)(=O)Cc3ccccc3)c2)n1.Cc1cccc(S(=O)(=O)n2ccc(NC(=O)c3ccccn3)c2)c1.N#Cc1cccc(S(=O)(=O)n2ccc(NC(=O)c3ccccn3)c2)c1.O=C(Cc1ccn(S(=O)(=O)Cc2ccccc2)c1)c1nccs1.O=C(Cc1ccn(S(=O)(=O)c2ccccc2Cl)c1)c1ccccc1.O=C(Nc1ccn(S(=O)(=O)c2ccc(F)cc2)c1)c1ccccn1.O=C(Nc1ccn(S(=O)(=O)c2ccc(OC(F)(F)F)cc2)c1)c1ccccn1.O=C(Nc1ccn(S(=O)(=O)c2ccc(OC(F)F)cc2)c1)c1ccccn1.O=C(Nc1ccn(S(=O)(=O)c2cccc(Cl)c2)c1)c1ccccn1
InChIInChI=1S/C20H21N3O3S.C19H18N2O3S.C18H14ClNO3S.C17H12F3N3O4S.C17H13F2N3O4S.C17H12N4O3S.C17H15N3O3S.C16H12ClN3O3S.C16H12FN3O3S.C16H14N2O3S2/c1-15(2)13-16-6-8-18(9-7-16)27(25,26)23-12-10-17(14-23)22-20(24)19-5-3-4-11-21-19;1-15-6-5-9-18(20-15)19(22)12-17-10-11-21(13-17)25(23,24)14-16-7-3-2-4-8-16;19-16-8-4-5-9-18(16)24(22,23)20-11-10-14(13-20)12-17(21)15-6-2-1-3-7-15;18-17(19,20)27-13-4-6-14(7-5-13)28(25,26)23-10-8-12(11-23)22-16(24)15-3-1-2-9-21-15;18-17(19)26-13-4-6-14(7-5-13)27(24,25)22-10-8-12(11-22)21-16(23)15-3-1-2-9-20-15;18-11-13-4-3-5-15(10-13)25(23,24)21-9-7-14(12-21)20-17(22)16-6-1-2-8-19-16;1-13-5-4-6-15(11-13)24(22,23)20-10-8-14(12-20)19-17(21)16-7-2-3-9-18-16;17-12-4-3-5-14(10-12)24(22,23)20-9-7-13(11-20)19-16(21)15-6-1-2-8-18-15;17-12-4-6-14(7-5-12)24(22,23)20-10-8-13(11-20)19-16(21)15-3-1-2-9-18-15;19-15(16-17-7-9-22-16)10-14-6-8-18(11-14)23(20,21)12-13-4-2-1-3-5-13/h3-12,14-15H,13H2,1-2H3,(H,22,24);2-11,13H,12,14H2,1H3;1-11,13H,12H2;1-11H,(H,22,24);1-11,17H,(H,21,23);1-10,12H,(H,20,22);2-12H,1H3,(H,19,21);2*1-11H,(H,19,21);1-9,11H,10,12H2
InChIKeyRCZCQBSQVZANNZ-UHFFFAOYSA-N
MW3649.83 g/mol
LogP29.82
Rot. Bonds50

About 2-(1-benzylsulfonylpyrrol-3-yl)-1-(6-methyl-2-pyridinyl)ethanone;2-(1-benzylsulfonylpyrrol-3-yl)-1-(1,3-thiazol-2-yl)ethanone;2-[1-(2-chlorophenyl)sulfonylpyrrol-3-yl]-1-phenylethanone;N-[1-(3-chlorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-cyanophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(difluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(4-fluorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-methylphenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(2-methylpropyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(trifluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide

2-(1-benzylsulfonylpyrrol-3-yl)-1-(6-methyl-2-pyridinyl)ethanone;2-(1-benzylsulfonylpyrrol-3-yl)-1-(1,3-thiazol-2-yl)ethanone;2-[1-(2-chlorophenyl)sulfonylpyrrol-3-yl]-1-phenylethanone;N-[1-(3-chlorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-cyanophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(difluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(4-fluorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-methylphenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(2-methylpropyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(trifluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide (PubChem CID 160590747) has the molecular formula C173H143Cl2F6N27O32S11 and a molecular weight of 3649.83 g/mol. Its IUPAC name is 2-(1-benzylsulfonylpyrrol-3-yl)-1-(6-methyl-2-pyridinyl)ethanone;2-(1-benzylsulfonylpyrrol-3-yl)-1-(1,3-thiazol-2-yl)ethanone;2-[1-(2-chlorophenyl)sulfonylpyrrol-3-yl]-1-phenylethanone;N-[1-(3-chlorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-cyanophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(difluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(4-fluorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-methylphenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(2-methylpropyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(trifluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name2-(1-benzylsulfonylpyrrol-3-yl)-1-(6-methyl-2-pyridinyl)ethanone;2-(1-benzylsulfonylpyrrol-3-yl)-1-(1,3-thiazol-2-yl)ethanone;2-[1-(2-chlorophenyl)sulfonylpyrrol-3-yl]-1-phenylethanone;N-[1-(3-chlorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-cyanophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(difluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(4-fluorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-methylphenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(2-methylpropyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(trifluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide
PubChem CID160590747
Molecular FormulaC173H143Cl2F6N27O32S11
Molecular Weight3649.83 g/mol
Exact Mass3645.66
IUPAC Name2-(1-benzylsulfonylpyrrol-3-yl)-1-(6-methyl-2-pyridinyl)ethanone;2-(1-benzylsulfonylpyrrol-3-yl)-1-(1,3-thiazol-2-yl)ethanone;2-[1-(2-chlorophenyl)sulfonylpyrrol-3-yl]-1-phenylethanone;N-[1-(3-chlorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-cyanophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(difluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(4-fluorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-methylphenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(2-methylpropyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(trifluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide
SMILESCC(C)Cc1ccc(S(=O)(=O)n2ccc(NC(=O)c3ccccn3)c2)cc1.Cc1cccc(C(=O)Cc2ccn(S(=O)(=O)Cc3ccccc3)c2)n1.Cc1cccc(S(=O)(=O)n2ccc(NC(=O)c3ccccn3)c2)c1.N#Cc1cccc(S(=O)(=O)n2ccc(NC(=O)c3ccccn3)c2)c1.O=C(Cc1ccn(S(=O)(=O)Cc2ccccc2)c1)c1nccs1.O=C(Cc1ccn(S(=O)(=O)c2ccccc2Cl)c1)c1ccccc1.O=C(Nc1ccn(S(=O)(=O)c2ccc(F)cc2)c1)c1ccccn1.O=C(Nc1ccn(S(=O)(=O)c2ccc(OC(F)(F)F)cc2)c1)c1ccccn1.O=C(Nc1ccn(S(=O)(=O)c2ccc(OC(F)F)cc2)c1)c1ccccn1.O=C(Nc1ccn(S(=O)(=O)c2cccc(Cl)c2)c1)c1ccccn1
InChIInChI=1S/C20H21N3O3S.C19H18N2O3S.C18H14ClNO3S.C17H12F3N3O4S.C17H13F2N3O4S.C17H12N4O3S.C17H15N3O3S.C16H12ClN3O3S.C16H12FN3O3S.C16H14N2O3S2/c1-15(2)13-16-6-8-18(9-7-16)27(25,26)23-12-10-17(14-23)22-20(24)19-5-3-4-11-21-19;1-15-6-5-9-18(20-15)19(22)12-17-10-11-21(13-17)25(23,24)14-16-7-3-2-4-8-16;19-16-8-4-5-9-18(16)24(22,23)20-11-10-14(13-20)12-17(21)15-6-2-1-3-7-15;18-17(19,20)27-13-4-6-14(7-5-13)28(25,26)23-10-8-12(11-23)22-16(24)15-3-1-2-9-21-15;18-17(19)26-13-4-6-14(7-5-13)27(24,25)22-10-8-12(11-22)21-16(23)15-3-1-2-9-20-15;18-11-13-4-3-5-15(10-13)25(23,24)21-9-7-14(12-21)20-17(22)16-6-1-2-8-19-16;1-13-5-4-6-15(11-13)24(22,23)20-10-8-14(12-20)19-17(21)16-7-2-3-9-18-16;17-12-4-3-5-14(10-12)24(22,23)20-9-7-13(11-20)19-16(21)15-6-1-2-8-18-15;17-12-4-6-14(7-5-12)24(22,23)20-10-8-13(11-20)19-16(21)15-3-1-2-9-18-15;19-15(16-17-7-9-22-16)10-14-6-8-18(11-14)23(20,21)12-13-4-2-1-3-5-13/h3-12,14-15H,13H2,1-2H3,(H,22,24);2-11,13H,12,14H2,1H3;1-11,13H,12H2;1-11H,(H,22,24);1-11,17H,(H,21,23);1-10,12H,(H,20,22);2-12H,1H3,(H,19,21);2*1-11H,(H,19,21);1-9,11H,10,12H2
InChIKeyRCZCQBSQVZANNZ-UHFFFAOYSA-N
XLogP29.82
TPSA803.87 Ų
H-Bond Donors7
H-Bond Acceptors53
Rotatable Bonds50
Heavy Atoms251
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003649.83
LogP ≤ 529.82
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1053

Analyze 2-(1-benzylsulfonylpyrrol-3-yl)-1-(6-methyl-2-pyridinyl)ethanone;2-(1-benzylsulfonylpyrrol-3-yl)-1-(1,3-thiazol-2-yl)ethanone;2-[1-(2-chlorophenyl)sulfonylpyrrol-3-yl]-1-phenylethanone;N-[1-(3-chlorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-cyanophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(difluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(4-fluorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-methylphenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(2-methylpropyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(trifluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(1-benzylsulfonylpyrrol-3-yl)-1-(6-methyl-2-pyridinyl)ethanone;2-(1-benzylsulfonylpyrrol-3-yl)-1-(1,3-thiazol-2-yl)ethanone;2-[1-(2-chlorophenyl)sulfonylpyrrol-3-yl]-1-phenylethanone;N-[1-(3-chlorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-cyanophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(difluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(4-fluorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-methylphenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(2-methylpropyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(trifluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide?
The IUPAC name of 2-(1-benzylsulfonylpyrrol-3-yl)-1-(6-methyl-2-pyridinyl)ethanone;2-(1-benzylsulfonylpyrrol-3-yl)-1-(1,3-thiazol-2-yl)ethanone;2-[1-(2-chlorophenyl)sulfonylpyrrol-3-yl]-1-phenylethanone;N-[1-(3-chlorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-cyanophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(difluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(4-fluorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-methylphenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(2-methylpropyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(trifluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide (CID 160590747) is 2-(1-benzylsulfonylpyrrol-3-yl)-1-(6-methyl-2-pyridinyl)ethanone;2-(1-benzylsulfonylpyrrol-3-yl)-1-(1,3-thiazol-2-yl)ethanone;2-[1-(2-chlorophenyl)sulfonylpyrrol-3-yl]-1-phenylethanone;N-[1-(3-chlorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-cyanophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(difluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(4-fluorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-methylphenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(2-methylpropyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(trifluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide.
What is the SMILES notation for 2-(1-benzylsulfonylpyrrol-3-yl)-1-(6-methyl-2-pyridinyl)ethanone;2-(1-benzylsulfonylpyrrol-3-yl)-1-(1,3-thiazol-2-yl)ethanone;2-[1-(2-chlorophenyl)sulfonylpyrrol-3-yl]-1-phenylethanone;N-[1-(3-chlorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-cyanophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(difluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(4-fluorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-methylphenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(2-methylpropyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(trifluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide?
The canonical SMILES for 2-(1-benzylsulfonylpyrrol-3-yl)-1-(6-methyl-2-pyridinyl)ethanone;2-(1-benzylsulfonylpyrrol-3-yl)-1-(1,3-thiazol-2-yl)ethanone;2-[1-(2-chlorophenyl)sulfonylpyrrol-3-yl]-1-phenylethanone;N-[1-(3-chlorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-cyanophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(difluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(4-fluorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-methylphenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(2-methylpropyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(trifluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide is CC(C)Cc1ccc(S(=O)(=O)n2ccc(NC(=O)c3ccccn3)c2)cc1.Cc1cccc(C(=O)Cc2ccn(S(=O)(=O)Cc3ccccc3)c2)n1.Cc1cccc(S(=O)(=O)n2ccc(NC(=O)c3ccccn3)c2)c1.N#Cc1cccc(S(=O)(=O)n2ccc(NC(=O)c3ccccn3)c2)c1.O=C(Cc1ccn(S(=O)(=O)Cc2ccccc2)c1)c1nccs1.O=C(Cc1ccn(S(=O)(=O)c2ccccc2Cl)c1)c1ccccc1.O=C(Nc1ccn(S(=O)(=O)c2ccc(F)cc2)c1)c1ccccn1.O=C(Nc1ccn(S(=O)(=O)c2ccc(OC(F)(F)F)cc2)c1)c1ccccn1.O=C(Nc1ccn(S(=O)(=O)c2ccc(OC(F)F)cc2)c1)c1ccccn1.O=C(Nc1ccn(S(=O)(=O)c2cccc(Cl)c2)c1)c1ccccn1.
What is the InChIKey of 2-(1-benzylsulfonylpyrrol-3-yl)-1-(6-methyl-2-pyridinyl)ethanone;2-(1-benzylsulfonylpyrrol-3-yl)-1-(1,3-thiazol-2-yl)ethanone;2-[1-(2-chlorophenyl)sulfonylpyrrol-3-yl]-1-phenylethanone;N-[1-(3-chlorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-cyanophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(difluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(4-fluorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-methylphenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(2-methylpropyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(trifluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide?
The InChIKey is RCZCQBSQVZANNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3S.C19H18N2O3S.C18H14ClNO3S.C17H12F3N3O4S.C17H13F2N3O4S.C17H12N4O3S.C17H15N3O3S.C16H12ClN3O3S.C16H12FN3O3S.C16H14N2O3S2/c1-15(2)13-16-6-8-18(9-7-16)27(25,26)23-12-10-17(14-23)22-20(24)19-5-3-4-11-21-19;1-15-6-5-9-18(20-15)19(22)12-17-10-11-21(13-17)25(23,24)14-16-7-3-2-4-8-16;19-16-8-4-5-9-18(16)24(22,23)20-11-10-14(13-20)12-17(21)15-6-2-1-3-7-15;18-17(19,20)27-13-4-6-14(7-5-13)28(25,26)23-10-8-12(11-23)22-16(24)15-3-1-2-9-21-15;18-17(19)26-13-4-6-14(7-5-13)27(24,25)22-10-8-12(11-22)21-16(23)15-3-1-2-9-20-15;18-11-13-4-3-5-15(10-13)25(23,24)21-9-7-14(12-21)20-17(22)16-6-1-2-8-19-16;1-13-5-4-6-15(11-13)24(22,23)20-10-8-14(12-20)19-17(21)16-7-2-3-9-18-16;17-12-4-3-5-14(10-12)24(22,23)20-9-7-13(11-20)19-16(21)15-6-1-2-8-18-15;17-12-4-6-14(7-5-12)24(22,23)20-10-8-13(11-20)19-16(21)15-3-1-2-9-18-15;19-15(16-17-7-9-22-16)10-14-6-8-18(11-14)23(20,21)12-13-4-2-1-3-5-13/h3-12,14-15H,13H2,1-2H3,(H,22,24);2-11,13H,12,14H2,1H3;1-11,13H,12H2;1-11H,(H,22,24);1-11,17H,(H,21,23);1-10,12H,(H,20,22);2-12H,1H3,(H,19,21);2*1-11H,(H,19,21);1-9,11H,10,12H2.
What are the key properties of 2-(1-benzylsulfonylpyrrol-3-yl)-1-(6-methyl-2-pyridinyl)ethanone;2-(1-benzylsulfonylpyrrol-3-yl)-1-(1,3-thiazol-2-yl)ethanone;2-[1-(2-chlorophenyl)sulfonylpyrrol-3-yl]-1-phenylethanone;N-[1-(3-chlorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-cyanophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(difluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(4-fluorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-methylphenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(2-methylpropyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(trifluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide?
2-(1-benzylsulfonylpyrrol-3-yl)-1-(6-methyl-2-pyridinyl)ethanone;2-(1-benzylsulfonylpyrrol-3-yl)-1-(1,3-thiazol-2-yl)ethanone;2-[1-(2-chlorophenyl)sulfonylpyrrol-3-yl]-1-phenylethanone;N-[1-(3-chlorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-cyanophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(difluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(4-fluorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-methylphenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(2-methylpropyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(trifluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide has a molecular weight of 3649.83 g/mol, XLogP of 29.82, 50 rotatable bonds, 7 hydrogen bond donors, and 53 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzylsulfonylpyrrol-3-yl)-1-(6-methyl-2-pyridinyl)ethanone;2-(1-benzylsulfonylpyrrol-3-yl)-1-(1,3-thiazol-2-yl)ethanone;2-[1-(2-chlorophenyl)sulfonylpyrrol-3-yl]-1-phenylethanone;N-[1-(3-chlorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-cyanophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(difluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(4-fluorophenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-(3-methylphenyl)sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(2-methylpropyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide;N-[1-[4-(trifluoromethoxy)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide is sourced from PubChem (CID 160590747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).