2-{[N-(butan-2-yl)-2-fluorobenzamido]methyl}-4-chlorophenyl methanesulfonate
Chemical Structure Depiction of
2-{[N-(butan-2-yl)-2-fluorobenzamido]methyl}-4-chlorophenyl methanesulfonate
2-{[N-(butan-2-yl)-2-fluorobenzamido]methyl}-4-chlorophenyl methanesulfonate
Compound characteristics
| Compound ID: | V025-4260 |
| Compound Name: | 2-{[N-(butan-2-yl)-2-fluorobenzamido]methyl}-4-chlorophenyl methanesulfonate |
| Molecular Weight: | 413.89 |
| Molecular Formula: | C19 H21 Cl F N O4 S |
| Smiles: | CCC(C)N(Cc1cc(ccc1OS(C)(=O)=O)[Cl])C(c1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3512 |
| logD: | 4.3512 |
| logSw: | -4.6018 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.013 |
| InChI Key: | QTZQPWADGFAIGN-ZDUSSCGKSA-N |