4-chloro-2-{[2-chloro-N-(propan-2-yl)benzamido]methyl}phenyl ethanesulfonate
Chemical Structure Depiction of
4-chloro-2-{[2-chloro-N-(propan-2-yl)benzamido]methyl}phenyl ethanesulfonate
4-chloro-2-{[2-chloro-N-(propan-2-yl)benzamido]methyl}phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V025-5426 |
| Compound Name: | 4-chloro-2-{[2-chloro-N-(propan-2-yl)benzamido]methyl}phenyl ethanesulfonate |
| Molecular Weight: | 430.35 |
| Molecular Formula: | C19 H21 Cl2 N O4 S |
| Smiles: | CCS(=O)(=O)Oc1ccc(cc1CN(C(C)C)C(c1ccccc1[Cl])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.4896 |
| logD: | 4.4896 |
| logSw: | -4.5801 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.389 |
| InChI Key: | VZXKTFFPXSZSLT-UHFFFAOYSA-N |