ethyl 4-[({3-[(2,3-dimethylphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(4-fluorophenyl)methyl]amino)methyl]benzoate
Chemical Structure Depiction of
ethyl 4-[({3-[(2,3-dimethylphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(4-fluorophenyl)methyl]amino)methyl]benzoate
ethyl 4-[({3-[(2,3-dimethylphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(4-fluorophenyl)methyl]amino)methyl]benzoate
Compound characteristics
| Compound ID: | K783-3620 |
| Compound Name: | ethyl 4-[({3-[(2,3-dimethylphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(4-fluorophenyl)methyl]amino)methyl]benzoate |
| Molecular Weight: | 592.66 |
| Molecular Formula: | C32 H30 F2 N2 O5 S |
| Smiles: | CCOC(c1ccc(CN(Cc2ccc(cc2)F)S(c2ccc(c(c2)C(Nc2cccc(C)c2C)=O)F)(=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.2299 |
| logD: | 7.2268 |
| logSw: | -5.6869 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.489 |
| InChI Key: | BERJXVQUVLCNJS-UHFFFAOYSA-N |