N-[5-[(2-chloro-4-methylphenyl)methylsulfanyl]-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-chloro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[1-(2-chlorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;bis(N-[5-[(2-fluoro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide);N-[5-[1-(2-fluorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-fluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide

C164H146Cl3F8N27O25S18 — CID 157407128

IUPACN-[5-[(2-chloro-4-methylphenyl)methylsulfanyl]-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-chloro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[1-(2-chlorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;bis(N-[5-[(2-fluoro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide);N-[5-[1-(2-fluorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-fluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide
SMILESCC(C)c1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)C(C)c1ccccc1Cl.CC(C)c1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)C(C)c1ccccc1F.CC(C)c1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)Cc1c(F)cccc1F.Cc1ccc(CS(=O)(=O)c2sc(NC(=O)c3ccccn3)nc2C)c(Cl)c1.Cc1ccc(CS(=O)(=O)c2sc(NC(=O)c3ccccn3)nc2C)c(F)c1.Cc1ccc(CS(=O)(=O)c2sc(NC(=O)c3ccccn3)nc2C)c(F)c1.Cc1ccc(CSc2cnc(NC(=O)c3ccccn3)s2)c(Cl)c1.Cc1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)Cc1c(F)cccc1F.Cc1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)Cc1ccccc1F
InChIInChI=1S/C20H20ClN3O3S2.C20H20FN3O3S2.C19H17F2N3O3S2.C18H16ClN3O3S2.2C18H16FN3O3S2.C17H14ClN3OS2.C17H13F2N3O3S2.C17H14FN3O3S2/c2*1-12(2)17-19(29(26,27)13(3)14-8-4-5-9-15(14)21)28-20(23-17)24-18(25)16-10-6-7-11-22-16;1-11(2)16-18(29(26,27)10-12-13(20)6-5-7-14(12)21)28-19(23-16)24-17(25)15-8-3-4-9-22-15;3*1-11-6-7-13(14(19)9-11)10-27(24,25)17-12(2)21-18(26-17)22-16(23)15-5-3-4-8-20-15;1-11-5-6-12(13(18)8-11)10-23-15-9-20-17(24-15)21-16(22)14-4-2-3-7-19-14;1-10-16(27(24,25)9-11-12(18)5-4-6-13(11)19)26-17(21-10)22-15(23)14-7-2-3-8-20-14;1-11-16(26(23,24)10-12-6-2-3-7-13(12)18)25-17(20-11)21-15(22)14-8-4-5-9-19-14/h2*4-13H,1-3H3,(H,23,24,25);3-9,11H,10H2,1-2H3,(H,23,24,25);3*3-9H,10H2,1-2H3,(H,21,22,23);2-9H,10H2,1H3,(H,20,21,22);2-8H,9H2,1H3,(H,21,22,23);2-9H,10H2,1H3,(H,20,21,22)
InChIKeyBNVSPWHRLUHKJS-UHFFFAOYSA-N
MW3730.68 g/mol
LogP36.54
Rot. Bonds48

About N-[5-[(2-chloro-4-methylphenyl)methylsulfanyl]-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-chloro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[1-(2-chlorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;bis(N-[5-[(2-fluoro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide);N-[5-[1-(2-fluorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-fluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide

N-[5-[(2-chloro-4-methylphenyl)methylsulfanyl]-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-chloro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[1-(2-chlorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;bis(N-[5-[(2-fluoro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide);N-[5-[1-(2-fluorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-fluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide (PubChem CID 157407128) has the molecular formula C164H146Cl3F8N27O25S18 and a molecular weight of 3730.68 g/mol. Its IUPAC name is N-[5-[(2-chloro-4-methylphenyl)methylsulfanyl]-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-chloro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[1-(2-chlorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;bis(N-[5-[(2-fluoro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide);N-[5-[1-(2-fluorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-fluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[5-[(2-chloro-4-methylphenyl)methylsulfanyl]-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-chloro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[1-(2-chlorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;bis(N-[5-[(2-fluoro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide);N-[5-[1-(2-fluorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-fluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide
PubChem CID157407128
Molecular FormulaC164H146Cl3F8N27O25S18
Molecular Weight3730.68 g/mol
Exact Mass3725.49
IUPAC NameN-[5-[(2-chloro-4-methylphenyl)methylsulfanyl]-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-chloro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[1-(2-chlorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;bis(N-[5-[(2-fluoro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide);N-[5-[1-(2-fluorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-fluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide
SMILESCC(C)c1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)C(C)c1ccccc1Cl.CC(C)c1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)C(C)c1ccccc1F.CC(C)c1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)Cc1c(F)cccc1F.Cc1ccc(CS(=O)(=O)c2sc(NC(=O)c3ccccn3)nc2C)c(Cl)c1.Cc1ccc(CS(=O)(=O)c2sc(NC(=O)c3ccccn3)nc2C)c(F)c1.Cc1ccc(CS(=O)(=O)c2sc(NC(=O)c3ccccn3)nc2C)c(F)c1.Cc1ccc(CSc2cnc(NC(=O)c3ccccn3)s2)c(Cl)c1.Cc1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)Cc1c(F)cccc1F.Cc1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)Cc1ccccc1F
InChIInChI=1S/C20H20ClN3O3S2.C20H20FN3O3S2.C19H17F2N3O3S2.C18H16ClN3O3S2.2C18H16FN3O3S2.C17H14ClN3OS2.C17H13F2N3O3S2.C17H14FN3O3S2/c2*1-12(2)17-19(29(26,27)13(3)14-8-4-5-9-15(14)21)28-20(23-17)24-18(25)16-10-6-7-11-22-16;1-11(2)16-18(29(26,27)10-12-13(20)6-5-7-14(12)21)28-19(23-16)24-17(25)15-8-3-4-9-22-15;3*1-11-6-7-13(14(19)9-11)10-27(24,25)17-12(2)21-18(26-17)22-16(23)15-5-3-4-8-20-15;1-11-5-6-12(13(18)8-11)10-23-15-9-20-17(24-15)21-16(22)14-4-2-3-7-19-14;1-10-16(27(24,25)9-11-12(18)5-4-6-13(11)19)26-17(21-10)22-15(23)14-7-2-3-8-20-14;1-11-16(26(23,24)10-12-6-2-3-7-13(12)18)25-17(20-11)21-15(22)14-8-4-5-9-19-14/h2*4-13H,1-3H3,(H,23,24,25);3-9,11H,10H2,1-2H3,(H,23,24,25);3*3-9H,10H2,1-2H3,(H,21,22,23);2-9H,10H2,1H3,(H,20,21,22);2-8H,9H2,1H3,(H,21,22,23);2-9H,10H2,1H3,(H,20,21,22)
InChIKeyBNVSPWHRLUHKJS-UHFFFAOYSA-N
XLogP36.54
TPSA767.04 Ų
H-Bond Donors9
H-Bond Acceptors53
Rotatable Bonds48
Heavy Atoms245
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003730.68
LogP ≤ 536.54
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1053

Analyze N-[5-[(2-chloro-4-methylphenyl)methylsulfanyl]-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-chloro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[1-(2-chlorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;bis(N-[5-[(2-fluoro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide);N-[5-[1-(2-fluorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-fluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[5-[(2-chloro-4-methylphenyl)methylsulfanyl]-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-chloro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[1-(2-chlorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;bis(N-[5-[(2-fluoro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide);N-[5-[1-(2-fluorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-fluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide?
The IUPAC name of N-[5-[(2-chloro-4-methylphenyl)methylsulfanyl]-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-chloro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[1-(2-chlorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;bis(N-[5-[(2-fluoro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide);N-[5-[1-(2-fluorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-fluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide (CID 157407128) is N-[5-[(2-chloro-4-methylphenyl)methylsulfanyl]-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-chloro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[1-(2-chlorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;bis(N-[5-[(2-fluoro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide);N-[5-[1-(2-fluorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-fluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide.
What is the SMILES notation for N-[5-[(2-chloro-4-methylphenyl)methylsulfanyl]-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-chloro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[1-(2-chlorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;bis(N-[5-[(2-fluoro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide);N-[5-[1-(2-fluorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-fluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide?
The canonical SMILES for N-[5-[(2-chloro-4-methylphenyl)methylsulfanyl]-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-chloro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[1-(2-chlorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;bis(N-[5-[(2-fluoro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide);N-[5-[1-(2-fluorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-fluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide is CC(C)c1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)C(C)c1ccccc1Cl.CC(C)c1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)C(C)c1ccccc1F.CC(C)c1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)Cc1c(F)cccc1F.Cc1ccc(CS(=O)(=O)c2sc(NC(=O)c3ccccn3)nc2C)c(Cl)c1.Cc1ccc(CS(=O)(=O)c2sc(NC(=O)c3ccccn3)nc2C)c(F)c1.Cc1ccc(CS(=O)(=O)c2sc(NC(=O)c3ccccn3)nc2C)c(F)c1.Cc1ccc(CSc2cnc(NC(=O)c3ccccn3)s2)c(Cl)c1.Cc1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)Cc1c(F)cccc1F.Cc1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)Cc1ccccc1F.
What is the InChIKey of N-[5-[(2-chloro-4-methylphenyl)methylsulfanyl]-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-chloro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[1-(2-chlorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;bis(N-[5-[(2-fluoro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide);N-[5-[1-(2-fluorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-fluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide?
The InChIKey is BNVSPWHRLUHKJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20ClN3O3S2.C20H20FN3O3S2.C19H17F2N3O3S2.C18H16ClN3O3S2.2C18H16FN3O3S2.C17H14ClN3OS2.C17H13F2N3O3S2.C17H14FN3O3S2/c2*1-12(2)17-19(29(26,27)13(3)14-8-4-5-9-15(14)21)28-20(23-17)24-18(25)16-10-6-7-11-22-16;1-11(2)16-18(29(26,27)10-12-13(20)6-5-7-14(12)21)28-19(23-16)24-17(25)15-8-3-4-9-22-15;3*1-11-6-7-13(14(19)9-11)10-27(24,25)17-12(2)21-18(26-17)22-16(23)15-5-3-4-8-20-15;1-11-5-6-12(13(18)8-11)10-23-15-9-20-17(24-15)21-16(22)14-4-2-3-7-19-14;1-10-16(27(24,25)9-11-12(18)5-4-6-13(11)19)26-17(21-10)22-15(23)14-7-2-3-8-20-14;1-11-16(26(23,24)10-12-6-2-3-7-13(12)18)25-17(20-11)21-15(22)14-8-4-5-9-19-14/h2*4-13H,1-3H3,(H,23,24,25);3-9,11H,10H2,1-2H3,(H,23,24,25);3*3-9H,10H2,1-2H3,(H,21,22,23);2-9H,10H2,1H3,(H,20,21,22);2-8H,9H2,1H3,(H,21,22,23);2-9H,10H2,1H3,(H,20,21,22).
What are the key properties of N-[5-[(2-chloro-4-methylphenyl)methylsulfanyl]-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-chloro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[1-(2-chlorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;bis(N-[5-[(2-fluoro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide);N-[5-[1-(2-fluorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-fluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide?
N-[5-[(2-chloro-4-methylphenyl)methylsulfanyl]-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-chloro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[1-(2-chlorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;bis(N-[5-[(2-fluoro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide);N-[5-[1-(2-fluorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-fluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide has a molecular weight of 3730.68 g/mol, XLogP of 36.54, 48 rotatable bonds, 9 hydrogen bond donors, and 53 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(2-chloro-4-methylphenyl)methylsulfanyl]-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-chloro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[1-(2-chlorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2,6-difluorophenyl)methylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;bis(N-[5-[(2-fluoro-4-methylphenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide);N-[5-[1-(2-fluorophenyl)ethylsulfonyl]-4-propan-2-yl-1,3-thiazol-2-yl]pyridine-2-carboxamide;N-[5-[(2-fluorophenyl)methylsulfonyl]-4-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide is sourced from PubChem (CID 157407128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).