4-chloro-2-{[(cyclobutanecarbonyl)(2-methoxyethyl)amino]methyl}phenyl ethanesulfonate
Chemical Structure Depiction of
4-chloro-2-{[(cyclobutanecarbonyl)(2-methoxyethyl)amino]methyl}phenyl ethanesulfonate
4-chloro-2-{[(cyclobutanecarbonyl)(2-methoxyethyl)amino]methyl}phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V026-4536 |
| Compound Name: | 4-chloro-2-{[(cyclobutanecarbonyl)(2-methoxyethyl)amino]methyl}phenyl ethanesulfonate |
| Molecular Weight: | 389.9 |
| Molecular Formula: | C17 H24 Cl N O5 S |
| Smiles: | CCS(=O)(=O)Oc1ccc(cc1CN(CCOC)C(C1CCC1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.4125 |
| logD: | 2.4125 |
| logSw: | -3.1028 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.489 |
| InChI Key: | GPSZYDZWANTKCR-UHFFFAOYSA-N |