ethyl 4-[({3-[(3,4-difluorophenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(4-methylphenyl)methyl]amino)methyl]benzoate
Chemical Structure Depiction of
ethyl 4-[({3-[(3,4-difluorophenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(4-methylphenyl)methyl]amino)methyl]benzoate
ethyl 4-[({3-[(3,4-difluorophenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(4-methylphenyl)methyl]amino)methyl]benzoate
Compound characteristics
| Compound ID: | K783-3586 |
| Compound Name: | ethyl 4-[({3-[(3,4-difluorophenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(4-methylphenyl)methyl]amino)methyl]benzoate |
| Molecular Weight: | 596.63 |
| Molecular Formula: | C31 H27 F3 N2 O5 S |
| Smiles: | CCOC(c1ccc(CN(Cc2ccc(C)cc2)S(c2ccc(c(c2)C(Nc2ccc(c(c2)F)F)=O)F)(=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.1521 |
| logD: | 5.674 |
| logSw: | -5.6399 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.187 |
| InChI Key: | AXTNZPXLZHVIBN-UHFFFAOYSA-N |