4-[(4-chloro-N-cyclopropylbenzamido)methyl]phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-[(4-chloro-N-cyclopropylbenzamido)methyl]phenyl 4-fluorobenzene-1-sulfonate
4-[(4-chloro-N-cyclopropylbenzamido)methyl]phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V012-2066 |
| Compound Name: | 4-[(4-chloro-N-cyclopropylbenzamido)methyl]phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 459.92 |
| Molecular Formula: | C23 H19 Cl F N O4 S |
| Smiles: | C1CC1N(Cc1ccc(cc1)OS(c1ccc(cc1)F)(=O)=O)C(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.0956 |
| logD: | 5.0956 |
| logSw: | -5.6056 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.515 |
| InChI Key: | OTJBUMLXMBYKGW-UHFFFAOYSA-N |