sodium--{[4-({(3-chloro-2-methylbenzene-1-sulfonyl)[(4-chlorophenyl)methyl]amino}methyl)cyclohexane-1-carbonyl]amino}oxidanide (1/1)
Chemical Structure Depiction of
sodium--{[4-({(3-chloro-2-methylbenzene-1-sulfonyl)[(4-chlorophenyl)methyl]amino}methyl)cyclohexane-1-carbonyl]amino}oxidanide (1/1)
sodium--{[4-({(3-chloro-2-methylbenzene-1-sulfonyl)[(4-chlorophenyl)methyl]amino}methyl)cyclohexane-1-carbonyl]amino}oxidanide (1/1)
Compound characteristics
| Compound ID: | K783-3634 |
| Compound Name: | sodium--{[4-({(3-chloro-2-methylbenzene-1-sulfonyl)[(4-chlorophenyl)methyl]amino}methyl)cyclohexane-1-carbonyl]amino}oxidanide (1/1) |
| Molecular Weight: | 507.41 |
| Molecular Formula: | C22 H25 Cl2 N2 O4 S |
| Salt: | Na+ |
| Smiles: | Cc1c(cccc1[Cl])S(N(CC1CCC(CC1)C(N[O-])=O)Cc1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8612 |
| logD: | 4.8612 |
| logSw: | -4.6211 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.46 |
| InChI Key: | UKBSIPPCIDBUEF-UHFFFAOYSA-N |