이름: cis-(1R,2S)-2-[(4-chlorophenyl)sulfonylamino]cyclohexane-1-carboxamide
SMILES:
C1CCC(C(C1)C(=O)N)NS(=O)(=O)C2=CC=C(C=C2)ClMolecular 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
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
76.71
Supplementary Information
InChIKey: KBEUIRIQXRDESU-NEPJUHHUSA-N
동의어
SCHEMBL6077223KBEUIRIQXRDESU-NEPJUHHUSA-Ncis-2-(4-chlorobenzenesulfonylamino)-cyclohexanecarboxylic acid amide(1R,2S)-2-(4-chlorobenzenesulfonylamino)-cyclohexanecarboxylic acid amidecis-2-(4-Chloro-benzenesulfonylamino)-cyclohexanecarboxylic acid amide
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