2-(4-chloro-2-fluorophenyl)sulfonyl-N'-[2-(4-chloro-2-fluorophenyl)sulfonyl-2-methylpropanoyl]-N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methyl-N-quinolin-2-ylpropanehydrazide;2-(4-chloro-2-fluorophenyl)sulfonyl-N-[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]-2-methylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-naphthalen-1-ylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(3-propyl-1,2-oxazol-5-yl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide

C125H116Cl8F10N12O23S8 — CID 173121554

IUPAC2-(4-chloro-2-fluorophenyl)sulfonyl-N'-[2-(4-chloro-2-fluorophenyl)sulfonyl-2-methylpropanoyl]-N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methyl-N-quinolin-2-ylpropanehydrazide;2-(4-chloro-2-fluorophenyl)sulfonyl-N-[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]-2-methylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-naphthalen-1-ylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(3-propyl-1,2-oxazol-5-yl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide
SMILESCC(C)(C(=O)N(c1ccc2ccccc2n1)N(C(=O)C(C)(C)S(=O)(=O)c1ccc(Cl)cc1F)c1nc(-c2ccc(Cl)cc2)cs1)S(=O)(=O)c1ccc(Cl)cc1F.CC(C)(C(=O)Nc1cccc(C(F)(F)F)c1)S(=O)(=O)c1ccc(Cl)cc1F.CC(C)(C(=O)Nc1cccc2ccccc12)S(=O)(=O)c1ccc(Cl)cc1F.CC(C)(C)Cc1cc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2F)on1.CCCc1cc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2F)on1.Cc1ccc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2F)nc1
InChIInChI=1S/C38H29Cl3F2N4O6S3.C20H17ClFNO3S.C18H22ClFN2O4S.C17H14ClF4NO3S.C16H18ClFN2O4S.C16H16ClFN2O3S/c1-37(2,55(50,51)31-16-14-25(40)19-27(31)42)34(48)46(33-18-11-22-7-5-6-8-29(22)44-33)47(36-45-30(21-54-36)23-9-12-24(39)13-10-23)35(49)38(3,4)56(52,53)32-17-15-26(41)20-28(32)43;1-20(2,27(25,26)18-11-10-14(21)12-16(18)22)19(24)23-17-9-5-7-13-6-3-4-8-15(13)17;1-17(2,3)10-12-9-15(26-22-12)21-16(23)18(4,5)27(24,25)14-7-6-11(19)8-13(14)20;1-16(2,27(25,26)14-7-6-11(18)9-13(14)19)15(24)23-12-5-3-4-10(8-12)17(20,21)22;1-4-5-11-9-14(24-20-11)19-15(21)16(2,3)25(22,23)13-7-6-10(17)8-12(13)18;1-10-4-7-14(19-9-10)20-15(21)16(2,3)24(22,23)13-6-5-11(17)8-12(13)18/h5-21H,1-4H3;3-12H,1-2H3,(H,23,24);6-9H,10H2,1-5H3,(H,21,23);3-9H,1-2H3,(H,23,24);6-9H,4-5H2,1-3H3,(H,19,21);4-9H,1-3H3,(H,19,20,21)
InChIKeyAGGCFQWHXXCQBN-UHFFFAOYSA-N
MW2884.50 g/mol
LogP30.13
Rot. Bonds32

About 2-(4-chloro-2-fluorophenyl)sulfonyl-N'-[2-(4-chloro-2-fluorophenyl)sulfonyl-2-methylpropanoyl]-N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methyl-N-quinolin-2-ylpropanehydrazide;2-(4-chloro-2-fluorophenyl)sulfonyl-N-[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]-2-methylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-naphthalen-1-ylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(3-propyl-1,2-oxazol-5-yl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide

2-(4-chloro-2-fluorophenyl)sulfonyl-N'-[2-(4-chloro-2-fluorophenyl)sulfonyl-2-methylpropanoyl]-N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methyl-N-quinolin-2-ylpropanehydrazide;2-(4-chloro-2-fluorophenyl)sulfonyl-N-[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]-2-methylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-naphthalen-1-ylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(3-propyl-1,2-oxazol-5-yl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide (PubChem CID 173121554) has the molecular formula C125H116Cl8F10N12O23S8 and a molecular weight of 2884.50 g/mol. Its IUPAC name is 2-(4-chloro-2-fluorophenyl)sulfonyl-N'-[2-(4-chloro-2-fluorophenyl)sulfonyl-2-methylpropanoyl]-N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methyl-N-quinolin-2-ylpropanehydrazide;2-(4-chloro-2-fluorophenyl)sulfonyl-N-[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]-2-methylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-naphthalen-1-ylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(3-propyl-1,2-oxazol-5-yl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide.

Molecular Properties

Compound Name2-(4-chloro-2-fluorophenyl)sulfonyl-N'-[2-(4-chloro-2-fluorophenyl)sulfonyl-2-methylpropanoyl]-N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methyl-N-quinolin-2-ylpropanehydrazide;2-(4-chloro-2-fluorophenyl)sulfonyl-N-[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]-2-methylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-naphthalen-1-ylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(3-propyl-1,2-oxazol-5-yl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide
PubChem CID173121554
Molecular FormulaC125H116Cl8F10N12O23S8
Molecular Weight2884.50 g/mol
Exact Mass2878.34
IUPAC Name2-(4-chloro-2-fluorophenyl)sulfonyl-N'-[2-(4-chloro-2-fluorophenyl)sulfonyl-2-methylpropanoyl]-N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methyl-N-quinolin-2-ylpropanehydrazide;2-(4-chloro-2-fluorophenyl)sulfonyl-N-[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]-2-methylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-naphthalen-1-ylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(3-propyl-1,2-oxazol-5-yl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide
SMILESCC(C)(C(=O)N(c1ccc2ccccc2n1)N(C(=O)C(C)(C)S(=O)(=O)c1ccc(Cl)cc1F)c1nc(-c2ccc(Cl)cc2)cs1)S(=O)(=O)c1ccc(Cl)cc1F.CC(C)(C(=O)Nc1cccc(C(F)(F)F)c1)S(=O)(=O)c1ccc(Cl)cc1F.CC(C)(C(=O)Nc1cccc2ccccc12)S(=O)(=O)c1ccc(Cl)cc1F.CC(C)(C)Cc1cc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2F)on1.CCCc1cc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2F)on1.Cc1ccc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2F)nc1
InChIInChI=1S/C38H29Cl3F2N4O6S3.C20H17ClFNO3S.C18H22ClFN2O4S.C17H14ClF4NO3S.C16H18ClFN2O4S.C16H16ClFN2O3S/c1-37(2,55(50,51)31-16-14-25(40)19-27(31)42)34(48)46(33-18-11-22-7-5-6-8-29(22)44-33)47(36-45-30(21-54-36)23-9-12-24(39)13-10-23)35(49)38(3,4)56(52,53)32-17-15-26(41)20-28(32)43;1-20(2,27(25,26)18-11-10-14(21)12-16(18)22)19(24)23-17-9-5-7-13-6-3-4-8-15(13)17;1-17(2,3)10-12-9-15(26-22-12)21-16(23)18(4,5)27(24,25)14-7-6-11(19)8-13(14)20;1-16(2,27(25,26)14-7-6-11(18)9-13(14)19)15(24)23-12-5-3-4-10(8-12)17(20,21)22;1-4-5-11-9-14(24-20-11)19-15(21)16(2,3)25(22,23)13-7-6-10(17)8-12(13)18;1-10-4-7-14(19-9-10)20-15(21)16(2,3)24(22,23)13-6-5-11(17)8-12(13)18/h5-21H,1-4H3;3-12H,1-2H3,(H,23,24);6-9H,10H2,1-5H3,(H,21,23);3-9H,1-2H3,(H,23,24);6-9H,4-5H2,1-3H3,(H,19,21);4-9H,1-3H3,(H,19,20,21)
InChIKeyAGGCFQWHXXCQBN-UHFFFAOYSA-N
XLogP30.13
TPSA515.83 Ų
H-Bond Donors5
H-Bond Acceptors29
Rotatable Bonds32
Heavy Atoms186
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002884.50
LogP ≤ 530.13
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-(4-chloro-2-fluorophenyl)sulfonyl-N'-[2-(4-chloro-2-fluorophenyl)sulfonyl-2-methylpropanoyl]-N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methyl-N-quinolin-2-ylpropanehydrazide;2-(4-chloro-2-fluorophenyl)sulfonyl-N-[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]-2-methylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-naphthalen-1-ylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(3-propyl-1,2-oxazol-5-yl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide with MolForge

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Related Compounds

2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide
CID 159353939
2-methyl-N-(5-methyl-2-pyridinyl)-2-(4-methylsulfonylphenyl)sulfonylpropanamide;2-methyl-2-(4-methylsulfonylphenyl)sulfonyl-N-naphthalen-1-ylpropanamide
CID 68901123
N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenyl)sulfonyl-2-methylpropanamide;N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(4-chlorophenyl)sulfonyl-2-methylpropanamide;N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)-2-(4-methoxyphenyl)sulfonyl-2-methylpropanamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-(2,4-dichlorophenyl)sulfonyl-2-methylpropanamide;N-(4-tert-butyl-1,3-thiazol-2-yl)-2-(2,4-dichlorophenyl)sulfonyl-2-methylpropanamide;2-(4-chlorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chlorophenyl)sulfonyl-2-methyl-N-(4-phenyl-1,3-thiazol-2-yl)propanamide;2-(4-chlorophenyl)sulfonyl-2-methyl-N-[5-(trifluoromethyl)-2-pyridinyl]propanamide
CID 173117775
2-(4-chlorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide
CID 44569507
4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 4680949
2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide
CID 67043617
4-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 5167161
2-(2,4-difluorophenyl)sulfonyl-N-isoquinolin-3-yl-2-methylpropanamide;2-(2,4-difluorophenyl)sulfonyl-2-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide
CID 87602417
N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)-2-(4-methoxyphenyl)sulfonyl-2-methylpropanamide;N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)-2-methyl-2-[3-(trifluoromethyl)phenyl]sulfonylpropanamide;N-(3-tert-butyl-1,2-oxazol-5-yl)-2-(4-chlorophenyl)sulfonyl-2-methylpropanamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-(4-methoxyphenyl)sulfonyl-2-methylpropanamide
CID 173117774
2-(4-ethylphenyl)-N-[3-(trifluoromethyl)phenyl]quinoline-4-carboxamide
CID 2163462
N-(5-tert-butyl-1,2-oxazol-3-yl)-2-methyl-2-[3-(trifluoromethyl)phenyl]sulfonylpropanamide;N-(4-tert-butyl-1,3-thiazol-2-yl)-2-methyl-2-[3-(trifluoromethyl)phenyl]sulfonylpropanamide
CID 161100841
2-(benzenesulfonyl)-N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)-2-methylpropanamide;5-tert-butyl-4-methyl-1,3-thiazol-2-amine;N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)-2-(3,4-dichlorophenyl)sulfonyl-2-methylpropanamide;N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)-2-(4-methoxyphenyl)sulfonyl-2-methylpropanamide;N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)-2-methyl-2-[3-(trifluoromethyl)phenyl]sulfonylpropanamide;N-(3-tert-butyl-1,2-oxazol-5-yl)-2-(4-chlorophenyl)sulfonyl-2-methylpropanamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-(3,4-dichlorophenyl)sulfonyl-2-methylpropanamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-(4-methoxyphenyl)sulfonyl-2-methylpropanamide;N-(4-tert-butyl-1,3-thiazol-2-yl)-2-(3,4-dichlorophenyl)sulfonyl-2-methylpropanamide
CID 173117637

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2-fluorophenyl)sulfonyl-N'-[2-(4-chloro-2-fluorophenyl)sulfonyl-2-methylpropanoyl]-N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methyl-N-quinolin-2-ylpropanehydrazide;2-(4-chloro-2-fluorophenyl)sulfonyl-N-[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]-2-methylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-naphthalen-1-ylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(3-propyl-1,2-oxazol-5-yl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide?
The IUPAC name of 2-(4-chloro-2-fluorophenyl)sulfonyl-N'-[2-(4-chloro-2-fluorophenyl)sulfonyl-2-methylpropanoyl]-N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methyl-N-quinolin-2-ylpropanehydrazide;2-(4-chloro-2-fluorophenyl)sulfonyl-N-[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]-2-methylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-naphthalen-1-ylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(3-propyl-1,2-oxazol-5-yl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide (CID 173121554) is 2-(4-chloro-2-fluorophenyl)sulfonyl-N'-[2-(4-chloro-2-fluorophenyl)sulfonyl-2-methylpropanoyl]-N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methyl-N-quinolin-2-ylpropanehydrazide;2-(4-chloro-2-fluorophenyl)sulfonyl-N-[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]-2-methylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-naphthalen-1-ylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(3-propyl-1,2-oxazol-5-yl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide.
What is the SMILES notation for 2-(4-chloro-2-fluorophenyl)sulfonyl-N'-[2-(4-chloro-2-fluorophenyl)sulfonyl-2-methylpropanoyl]-N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methyl-N-quinolin-2-ylpropanehydrazide;2-(4-chloro-2-fluorophenyl)sulfonyl-N-[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]-2-methylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-naphthalen-1-ylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(3-propyl-1,2-oxazol-5-yl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide?
The canonical SMILES for 2-(4-chloro-2-fluorophenyl)sulfonyl-N'-[2-(4-chloro-2-fluorophenyl)sulfonyl-2-methylpropanoyl]-N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methyl-N-quinolin-2-ylpropanehydrazide;2-(4-chloro-2-fluorophenyl)sulfonyl-N-[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]-2-methylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-naphthalen-1-ylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(3-propyl-1,2-oxazol-5-yl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide is CC(C)(C(=O)N(c1ccc2ccccc2n1)N(C(=O)C(C)(C)S(=O)(=O)c1ccc(Cl)cc1F)c1nc(-c2ccc(Cl)cc2)cs1)S(=O)(=O)c1ccc(Cl)cc1F.CC(C)(C(=O)Nc1cccc(C(F)(F)F)c1)S(=O)(=O)c1ccc(Cl)cc1F.CC(C)(C(=O)Nc1cccc2ccccc12)S(=O)(=O)c1ccc(Cl)cc1F.CC(C)(C)Cc1cc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2F)on1.CCCc1cc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2F)on1.Cc1ccc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2F)nc1.
What is the InChIKey of 2-(4-chloro-2-fluorophenyl)sulfonyl-N'-[2-(4-chloro-2-fluorophenyl)sulfonyl-2-methylpropanoyl]-N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methyl-N-quinolin-2-ylpropanehydrazide;2-(4-chloro-2-fluorophenyl)sulfonyl-N-[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]-2-methylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-naphthalen-1-ylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(3-propyl-1,2-oxazol-5-yl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide?
The InChIKey is AGGCFQWHXXCQBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H29Cl3F2N4O6S3.C20H17ClFNO3S.C18H22ClFN2O4S.C17H14ClF4NO3S.C16H18ClFN2O4S.C16H16ClFN2O3S/c1-37(2,55(50,51)31-16-14-25(40)19-27(31)42)34(48)46(33-18-11-22-7-5-6-8-29(22)44-33)47(36-45-30(21-54-36)23-9-12-24(39)13-10-23)35(49)38(3,4)56(52,53)32-17-15-26(41)20-28(32)43;1-20(2,27(25,26)18-11-10-14(21)12-16(18)22)19(24)23-17-9-5-7-13-6-3-4-8-15(13)17;1-17(2,3)10-12-9-15(26-22-12)21-16(23)18(4,5)27(24,25)14-7-6-11(19)8-13(14)20;1-16(2,27(25,26)14-7-6-11(18)9-13(14)19)15(24)23-12-5-3-4-10(8-12)17(20,21)22;1-4-5-11-9-14(24-20-11)19-15(21)16(2,3)25(22,23)13-7-6-10(17)8-12(13)18;1-10-4-7-14(19-9-10)20-15(21)16(2,3)24(22,23)13-6-5-11(17)8-12(13)18/h5-21H,1-4H3;3-12H,1-2H3,(H,23,24);6-9H,10H2,1-5H3,(H,21,23);3-9H,1-2H3,(H,23,24);6-9H,4-5H2,1-3H3,(H,19,21);4-9H,1-3H3,(H,19,20,21).
What are the key properties of 2-(4-chloro-2-fluorophenyl)sulfonyl-N'-[2-(4-chloro-2-fluorophenyl)sulfonyl-2-methylpropanoyl]-N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methyl-N-quinolin-2-ylpropanehydrazide;2-(4-chloro-2-fluorophenyl)sulfonyl-N-[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]-2-methylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-naphthalen-1-ylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(3-propyl-1,2-oxazol-5-yl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide?
2-(4-chloro-2-fluorophenyl)sulfonyl-N'-[2-(4-chloro-2-fluorophenyl)sulfonyl-2-methylpropanoyl]-N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methyl-N-quinolin-2-ylpropanehydrazide;2-(4-chloro-2-fluorophenyl)sulfonyl-N-[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]-2-methylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-naphthalen-1-ylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(3-propyl-1,2-oxazol-5-yl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide has a molecular weight of 2884.50 g/mol, XLogP of 30.13, 32 rotatable bonds, 5 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2-fluorophenyl)sulfonyl-N'-[2-(4-chloro-2-fluorophenyl)sulfonyl-2-methylpropanoyl]-N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methyl-N-quinolin-2-ylpropanehydrazide;2-(4-chloro-2-fluorophenyl)sulfonyl-N-[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]-2-methylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-naphthalen-1-ylpropanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(3-propyl-1,2-oxazol-5-yl)propanamide;2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide is sourced from PubChem (CID 173121554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).