2-[(N-cyclopropyl-2-fluorobenzamido)methyl]-5-(diethylamino)phenyl ethanesulfonate
Chemical Structure Depiction of
2-[(N-cyclopropyl-2-fluorobenzamido)methyl]-5-(diethylamino)phenyl ethanesulfonate
2-[(N-cyclopropyl-2-fluorobenzamido)methyl]-5-(diethylamino)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V026-5766 |
| Compound Name: | 2-[(N-cyclopropyl-2-fluorobenzamido)methyl]-5-(diethylamino)phenyl ethanesulfonate |
| Molecular Weight: | 448.56 |
| Molecular Formula: | C23 H29 F N2 O4 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(C2CC2)C(c2ccccc2F)=O)c(c1)OS(CC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.343 |
| logD: | 4.3335 |
| logSw: | -4.4103 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.685 |
| InChI Key: | PHYYFZREMZOZOD-UHFFFAOYSA-N |