4-[(N-cyclopropyl-2-methylbenzamido)methyl]phenyl ethanesulfonate
Chemical Structure Depiction of
4-[(N-cyclopropyl-2-methylbenzamido)methyl]phenyl ethanesulfonate
4-[(N-cyclopropyl-2-methylbenzamido)methyl]phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V007-0746 |
| Compound Name: | 4-[(N-cyclopropyl-2-methylbenzamido)methyl]phenyl ethanesulfonate |
| Molecular Weight: | 373.47 |
| Molecular Formula: | C20 H23 N O4 S |
| Smiles: | CCS(=O)(=O)Oc1ccc(CN(C2CC2)C(c2ccccc2C)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4344 |
| logD: | 3.4344 |
| logSw: | -3.6636 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.862 |
| InChI Key: | BJSZSCZXKAVQRU-UHFFFAOYSA-N |