2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluorobutan-2-yl]benzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide

C114H128Cl10F8N26O25S10 — CID 159396758

IUPAC2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluorobutan-2-yl]benzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide
SMILESCC(C)NS(=O)(=O)c1ccc(-c2sc(-c3nnc(C(C)(C)O)o3)nc2C(=O)N2CCC(F)CC2)c(Cl)c1Cl.CC(C)NS(=O)(=O)c1ccc(-c2sc(-c3nnc(C(C)(C)O)o3)nc2C(=O)N2CCCC[C@@H]2C)c(Cl)c1Cl.CCN(CC)C(=O)c1nc(-c2nnc(C(N)=O)o2)sc1-c1ccc(S(=O)(=O)NC(C)C)c(Cl)c1Cl.CC[C@H](NS(=O)(=O)c1ccc(-c2sc(-c3nnc(C(C)(C)O)o3)nc2C(=O)N(CC)CC)c(Cl)c1Cl)C(F)(F)F.CC[C@H](NS(=O)(=O)c1ccc(-c2sc(-c3nnc(C(C)(C)O)o3)nc2C(=O)N2CCC(F)CC2)c(Cl)c1Cl)C(F)(F)F
InChIInChI=1S/C24H25Cl2F4N5O5S2.C24H29Cl2N5O5S2.C23H26Cl2F3N5O5S2.C23H26Cl2FN5O5S2.C20H22Cl2N6O5S2/c1-4-14(24(28,29)30)34-42(38,39)13-6-5-12(15(25)16(13)26)18-17(21(36)35-9-7-11(27)8-10-35)31-20(41-18)19-32-33-22(40-19)23(2,3)37;1-12(2)30-38(34,35)15-10-9-14(16(25)17(15)26)19-18(22(32)31-11-7-6-8-13(31)3)27-21(37-19)20-28-29-23(36-20)24(4,5)33;1-6-13(23(26,27)28)32-40(36,37)12-10-9-11(14(24)15(12)25)17-16(20(34)33(7-2)8-3)29-19(39-17)18-30-31-21(38-18)22(4,5)35;1-11(2)30-38(34,35)14-6-5-13(15(24)16(14)25)18-17(21(32)31-9-7-12(26)8-10-31)27-20(37-18)19-28-29-22(36-19)23(3,4)33;1-5-28(6-2)20(30)14-15(34-19(24-14)18-26-25-17(33-18)16(23)29)10-7-8-11(13(22)12(10)21)35(31,32)27-9(3)4/h5-6,11,14,34,37H,4,7-10H2,1-3H3;9-10,12-13,30,33H,6-8,11H2,1-5H3;9-10,13,32,35H,6-8H2,1-5H3;5-6,11-12,30,33H,7-10H2,1-4H3;7-9,27H,5-6H2,1-4H3,(H2,23,29)/t14-;2*13-;;/m000../s1
InChIKeyLMUZDQMTDMCISK-NKXBXWRJSA-N
MW3089.62 g/mol
LogP24.27
Rot. Bonds41

About 2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluorobutan-2-yl]benzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide

2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluorobutan-2-yl]benzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide (PubChem CID 159396758) has the molecular formula C114H128Cl10F8N26O25S10 and a molecular weight of 3089.62 g/mol. Its IUPAC name is 2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluorobutan-2-yl]benzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluorobutan-2-yl]benzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide
PubChem CID159396758
Molecular FormulaC114H128Cl10F8N26O25S10
Molecular Weight3089.62 g/mol
Exact Mass3082.35
IUPAC Name2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluorobutan-2-yl]benzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide
SMILESCC(C)NS(=O)(=O)c1ccc(-c2sc(-c3nnc(C(C)(C)O)o3)nc2C(=O)N2CCC(F)CC2)c(Cl)c1Cl.CC(C)NS(=O)(=O)c1ccc(-c2sc(-c3nnc(C(C)(C)O)o3)nc2C(=O)N2CCCC[C@@H]2C)c(Cl)c1Cl.CCN(CC)C(=O)c1nc(-c2nnc(C(N)=O)o2)sc1-c1ccc(S(=O)(=O)NC(C)C)c(Cl)c1Cl.CC[C@H](NS(=O)(=O)c1ccc(-c2sc(-c3nnc(C(C)(C)O)o3)nc2C(=O)N(CC)CC)c(Cl)c1Cl)C(F)(F)F.CC[C@H](NS(=O)(=O)c1ccc(-c2sc(-c3nnc(C(C)(C)O)o3)nc2C(=O)N2CCC(F)CC2)c(Cl)c1Cl)C(F)(F)F
InChIInChI=1S/C24H25Cl2F4N5O5S2.C24H29Cl2N5O5S2.C23H26Cl2F3N5O5S2.C23H26Cl2FN5O5S2.C20H22Cl2N6O5S2/c1-4-14(24(28,29)30)34-42(38,39)13-6-5-12(15(25)16(13)26)18-17(21(36)35-9-7-11(27)8-10-35)31-20(41-18)19-32-33-22(40-19)23(2,3)37;1-12(2)30-38(34,35)15-10-9-14(16(25)17(15)26)19-18(22(32)31-11-7-6-8-13(31)3)27-21(37-19)20-28-29-23(36-20)24(4,5)33;1-6-13(23(26,27)28)32-40(36,37)12-10-9-11(14(24)15(12)25)17-16(20(34)33(7-2)8-3)29-19(39-17)18-30-31-21(38-18)22(4,5)35;1-11(2)30-38(34,35)14-6-5-13(15(24)16(14)25)18-17(21(32)31-9-7-12(26)8-10-31)27-20(37-18)19-28-29-22(36-19)23(3,4)33;1-5-28(6-2)20(30)14-15(34-19(24-14)18-26-25-17(33-18)16(23)29)10-7-8-11(13(22)12(10)21)35(31,32)27-9(3)4/h5-6,11,14,34,37H,4,7-10H2,1-3H3;9-10,12-13,30,33H,6-8,11H2,1-5H3;9-10,13,32,35H,6-8H2,1-5H3;5-6,11-12,30,33H,7-10H2,1-4H3;7-9,27H,5-6H2,1-4H3,(H2,23,29)/t14-;2*13-;;/m000../s1
InChIKeyLMUZDQMTDMCISK-NKXBXWRJSA-N
XLogP24.27
TPSA715.46 Ų
H-Bond Donors10
H-Bond Acceptors45
Rotatable Bonds41
Heavy Atoms193
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003089.62
LogP ≤ 524.27
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1045

Analyze 2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluorobutan-2-yl]benzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide with MolForge

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Related Compounds

2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide;5-[4-(4-methylpiperidine-1-carbonyl)-5-[4-(propan-2-ylsulfamoyl)naphthalen-1-yl]-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide
CID 161031405
N-[(2R)-butan-2-yl]-2,3-dichloro-4-[2-[5-(2-cyano-2-methylpropyl)-1,3,4-oxadiazol-2-yl]-4-(4-fluoropiperidine-1-carbonyl)-1,3-thiazol-5-yl]benzenesulfonamide;[1-[5-[5-[4-[[(2R)-butan-2-yl]sulfamoyl]-2,3-dichlorophenyl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-2-yl]-1,3,4-oxadiazol-2-yl]-2-methylpropan-2-yl] formate;[1-[5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazol-2-yl]-2-methylpropan-2-yl] formate;5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-N,N-diethyl-2-[5-(2-hydroxy-2-methylpropyl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide;3-[5-[5-[2,3-dichloro-4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenyl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-2-yl]-1,3,4-oxadiazol-2-yl]-2,2-dimethylpropanoic acid
CID 159551920
3-[5-[5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-4-(4-fluoropiperidine-1-carbonyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazol-2-yl]-2,2-dimethylpropanoic acid
CID 121303861
2,3-dichloro-4-[4-(4,4-difluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide
CID 121308252
3-chloro-4-[4-(3,3-difluoroazetidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-(1,1,1-trifluorobutan-2-yl)benzenesulfonamide
CID 121303731
3-chloro-4-[4-(4,4-difluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-2-methyl-N-propan-2-ylbenzenesulfonamide;[5-[2-(difluoromethyl)-4-(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)phenyl]-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-4-yl]-(4,4-difluoropiperidin-1-yl)methanone;[5-[2-(difluoromethyl)-4-(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)phenyl]-2-[5-(2-hydroxypropan-2-yl)-1,2,4-oxadiazol-3-yl]-1,3-thiazol-4-yl]-[(2S)-2-methylpyrrolidin-1-yl]methanone;bis([5-[4-(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)-2-methylphenyl]-2-[5-(2-hydroxypropan-2-yl)-1,2,4-oxadiazol-3-yl]-1,3-thiazol-4-yl]-[(2S)-2-methylpyrrolidin-1-yl]methanone)
CID 158958507
3-chloro-4-[4-[(2S)-4,4-difluoro-2-methylpyrrolidine-1-carbonyl]-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-2-fluoro-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-[(2S)-4,4-difluoro-2-methylpyrrolidine-1-carbonyl]-2-[5-(2-hydroxypropan-2-yl)-1H-1,2,4-triazol-3-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-N,N-diethyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3-thiazole-4-carboxamide;5-[2,3-dichloro-4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenyl]-N,N-diethyl-2-[4-(2-hydroxy-2-methylpropyl)-1,2,4-triazol-3-yl]-1,3-thiazole-4-carboxamide
CID 158823165
2,3-dichloro-4-[4-(4,4-difluoropiperidine-1-carbonyl)-2-[5-(methylsulfonylmethyl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide
CID 121304023
2,3-dichloro-4-[4-(4,4-difluoropiperidine-1-carbonyl)-2-[5-(1-methoxycyclopropyl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide
CID 121308289
5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-N,N-diethyl-2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]-1,3-thiazole-4-carboxamide
CID 121308286
2,3-dichloro-4-[2-[4-cyclopropyl-5-(2-hydroxypropan-2-yl)-1,2,4-triazol-3-yl]-4-(4,4-difluoropiperidine-1-carbonyl)-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide
CID 121308316
[5-[6-(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)-4-(trifluoromethyl)-3-pyridinyl]-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-4-yl]-[(2S)-2-methylpyrrolidin-1-yl]methanone
CID 121308330

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluorobutan-2-yl]benzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide?
The IUPAC name of 2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluorobutan-2-yl]benzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide (CID 159396758) is 2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluorobutan-2-yl]benzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluorobutan-2-yl]benzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluorobutan-2-yl]benzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide is CC(C)NS(=O)(=O)c1ccc(-c2sc(-c3nnc(C(C)(C)O)o3)nc2C(=O)N2CCC(F)CC2)c(Cl)c1Cl.CC(C)NS(=O)(=O)c1ccc(-c2sc(-c3nnc(C(C)(C)O)o3)nc2C(=O)N2CCCC[C@@H]2C)c(Cl)c1Cl.CCN(CC)C(=O)c1nc(-c2nnc(C(N)=O)o2)sc1-c1ccc(S(=O)(=O)NC(C)C)c(Cl)c1Cl.CC[C@H](NS(=O)(=O)c1ccc(-c2sc(-c3nnc(C(C)(C)O)o3)nc2C(=O)N(CC)CC)c(Cl)c1Cl)C(F)(F)F.CC[C@H](NS(=O)(=O)c1ccc(-c2sc(-c3nnc(C(C)(C)O)o3)nc2C(=O)N2CCC(F)CC2)c(Cl)c1Cl)C(F)(F)F.
What is the InChIKey of 2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluorobutan-2-yl]benzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide?
The InChIKey is LMUZDQMTDMCISK-NKXBXWRJSA-N. The full InChI is InChI=1S/C24H25Cl2F4N5O5S2.C24H29Cl2N5O5S2.C23H26Cl2F3N5O5S2.C23H26Cl2FN5O5S2.C20H22Cl2N6O5S2/c1-4-14(24(28,29)30)34-42(38,39)13-6-5-12(15(25)16(13)26)18-17(21(36)35-9-7-11(27)8-10-35)31-20(41-18)19-32-33-22(40-19)23(2,3)37;1-12(2)30-38(34,35)15-10-9-14(16(25)17(15)26)19-18(22(32)31-11-7-6-8-13(31)3)27-21(37-19)20-28-29-23(36-20)24(4,5)33;1-6-13(23(26,27)28)32-40(36,37)12-10-9-11(14(24)15(12)25)17-16(20(34)33(7-2)8-3)29-19(39-17)18-30-31-21(38-18)22(4,5)35;1-11(2)30-38(34,35)14-6-5-13(15(24)16(14)25)18-17(21(32)31-9-7-12(26)8-10-31)27-20(37-18)19-28-29-22(36-19)23(3,4)33;1-5-28(6-2)20(30)14-15(34-19(24-14)18-26-25-17(33-18)16(23)29)10-7-8-11(13(22)12(10)21)35(31,32)27-9(3)4/h5-6,11,14,34,37H,4,7-10H2,1-3H3;9-10,12-13,30,33H,6-8,11H2,1-5H3;9-10,13,32,35H,6-8H2,1-5H3;5-6,11-12,30,33H,7-10H2,1-4H3;7-9,27H,5-6H2,1-4H3,(H2,23,29)/t14-;2*13-;;/m000../s1.
What are the key properties of 2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluorobutan-2-yl]benzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide?
2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluorobutan-2-yl]benzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide has a molecular weight of 3089.62 g/mol, XLogP of 24.27, 41 rotatable bonds, 10 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;2,3-dichloro-4-[4-(4-fluoropiperidine-1-carbonyl)-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazol-5-yl]-N-[(2S)-1,1,1-trifluorobutan-2-yl]benzenesulfonamide;2,3-dichloro-4-[2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-4-[(2S)-2-methylpiperidine-1-carbonyl]-1,3-thiazol-5-yl]-N-propan-2-ylbenzenesulfonamide;5-[5-[2,3-dichloro-4-(propan-2-ylsulfamoyl)phenyl]-4-(diethylcarbamoyl)-1,3-thiazol-2-yl]-1,3,4-oxadiazole-2-carboxamide;5-[2,3-dichloro-4-[[(2S)-1,1,1-trifluorobutan-2-yl]sulfamoyl]phenyl]-N,N-diethyl-2-[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 159396758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).