4-[(3-cyclopentyl-N-cyclopropylpropanamido)methyl]phenyl ethanesulfonate
Chemical Structure Depiction of
4-[(3-cyclopentyl-N-cyclopropylpropanamido)methyl]phenyl ethanesulfonate
4-[(3-cyclopentyl-N-cyclopropylpropanamido)methyl]phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V007-0725 |
| Compound Name: | 4-[(3-cyclopentyl-N-cyclopropylpropanamido)methyl]phenyl ethanesulfonate |
| Molecular Weight: | 379.52 |
| Molecular Formula: | C20 H29 N O4 S |
| Smiles: | CCS(=O)(=O)Oc1ccc(CN(C2CC2)C(CCC2CCCC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.636 |
| logD: | 3.636 |
| logSw: | -3.8419 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.893 |
| InChI Key: | PQTCURCCONQSGA-UHFFFAOYSA-N |