2-[(N-cyclopropyl-3-fluorobenzamido)methyl]phenyl ethanesulfonate
Chemical Structure Depiction of
2-[(N-cyclopropyl-3-fluorobenzamido)methyl]phenyl ethanesulfonate
2-[(N-cyclopropyl-3-fluorobenzamido)methyl]phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V027-0030 |
| Compound Name: | 2-[(N-cyclopropyl-3-fluorobenzamido)methyl]phenyl ethanesulfonate |
| Molecular Weight: | 377.43 |
| Molecular Formula: | C19 H20 F N O4 S |
| Smiles: | CCS(=O)(=O)Oc1ccccc1CN(C1CC1)C(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5397 |
| logD: | 3.5397 |
| logSw: | -3.6947 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.949 |
| InChI Key: | DEJDESBHCPKTOX-UHFFFAOYSA-N |