2-[(N-cyclopropyl-3-fluorobenzamido)methyl]-5-(diethylamino)phenyl methanesulfonate
Chemical Structure Depiction of
2-[(N-cyclopropyl-3-fluorobenzamido)methyl]-5-(diethylamino)phenyl methanesulfonate
2-[(N-cyclopropyl-3-fluorobenzamido)methyl]-5-(diethylamino)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V026-4522 |
| Compound Name: | 2-[(N-cyclopropyl-3-fluorobenzamido)methyl]-5-(diethylamino)phenyl methanesulfonate |
| Molecular Weight: | 434.53 |
| Molecular Formula: | C22 H27 F N2 O4 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(C2CC2)C(c2cccc(c2)F)=O)c(c1)OS(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9688 |
| logD: | 3.9593 |
| logSw: | -3.9883 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.725 |
| InChI Key: | ZAYQIQOFXMOGFS-UHFFFAOYSA-N |