NC(=O)[C@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1
الاسم: cis-(1S,2R)-2-[(4-chlorophenyl)sulfonylamino]cyclohexane-1-carboxamide
SMILES: NC(=O)[C@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1

Molecular Processing

Molecular formula
C13H17ClN2O3S
Molecular weight
316.81
Exact mass
316.0648
XLogP
1.66
TPSA
89.26
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
76.71

Supplementary Information

InChIKey: KBEUIRIQXRDESU-NWDGAFQWSA-N
مرادفات
SCHEMBL6078980KBEUIRIQXRDESU-NWDGAFQWSA-N(1S,2R)-2-(4-chlorobenzenesulfonylamino)-cyclohexanecarboxylic acid amide
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