2-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
2-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-4778 |
| Compound Name: | 2-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 473.95 |
| Molecular Formula: | C24 H21 Cl F N O4 S |
| Smiles: | C1CC1CN(Cc1ccccc1OS(c1ccc(cc1)F)(=O)=O)C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2262 |
| logD: | 5.2262 |
| logSw: | -5.4575 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.549 |
| InChI Key: | PWONIMQWVFAZII-UHFFFAOYSA-N |