2-({2-chloro-N-[(4-fluorophenyl)methyl]benzamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-({2-chloro-N-[(4-fluorophenyl)methyl]benzamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
2-({2-chloro-N-[(4-fluorophenyl)methyl]benzamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V016-3969 |
| Compound Name: | 2-({2-chloro-N-[(4-fluorophenyl)methyl]benzamido}methyl)phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 540.01 |
| Molecular Formula: | C28 H23 Cl F N O5 S |
| Smiles: | COc1ccc(cc1)S(=O)(=O)Oc1ccccc1CN(Cc1ccc(cc1)F)C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.6619 |
| logD: | 5.6619 |
| logSw: | -5.7785 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.57 |
| InChI Key: | QEXXODLJEVKUFI-UHFFFAOYSA-N |