2-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl methanesulfonate
Chemical Structure Depiction of
2-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl methanesulfonate
2-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl methanesulfonate
Compound characteristics
| Compound ID: | V025-4595 |
| Compound Name: | 2-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl methanesulfonate |
| Molecular Weight: | 393.89 |
| Molecular Formula: | C19 H20 Cl N O4 S |
| Smiles: | CS(=O)(=O)Oc1ccccc1CN(CC1CC1)C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5763 |
| logD: | 3.5763 |
| logSw: | -3.8577 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.937 |
| InChI Key: | NQJDTGIWIFHGMN-UHFFFAOYSA-N |