4-({[(4-chlorophenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}methyl)cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
4-({[(4-chlorophenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}methyl)cyclohexane-1-carboxylic acid
4-({[(4-chlorophenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}methyl)cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | K783-2617 |
| Compound Name: | 4-({[(4-chlorophenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}methyl)cyclohexane-1-carboxylic acid |
| Molecular Weight: | 466.94 |
| Molecular Formula: | C21 H23 Cl N2 O6 S |
| Smiles: | C1CC(CCC1CN(Cc1ccc(cc1)[Cl])S(c1ccc(cc1)[N+]([O-])=O)(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4135 |
| logD: | 1.8531 |
| logSw: | -4.593 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.324 |
| InChI Key: | JUYMFNICTPXHDT-UHFFFAOYSA-N |