ethyl 4-[({3-[(4-chloro-2-fluorophenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(4-methylphenyl)methyl]amino)methyl]benzoate
Chemical Structure Depiction of
ethyl 4-[({3-[(4-chloro-2-fluorophenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(4-methylphenyl)methyl]amino)methyl]benzoate
ethyl 4-[({3-[(4-chloro-2-fluorophenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(4-methylphenyl)methyl]amino)methyl]benzoate
Compound characteristics
| Compound ID: | K783-3587 |
| Compound Name: | ethyl 4-[({3-[(4-chloro-2-fluorophenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(4-methylphenyl)methyl]amino)methyl]benzoate |
| Molecular Weight: | 613.08 |
| Molecular Formula: | C31 H27 Cl F2 N2 O5 S |
| Smiles: | CCOC(c1ccc(CN(Cc2ccc(C)cc2)S(c2ccc(c(c2)C(Nc2ccc(cc2F)[Cl])=O)F)(=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.6156 |
| logD: | 6.1316 |
| logSw: | -6.3435 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.489 |
| InChI Key: | YTTZWZFSMONRHB-UHFFFAOYSA-N |