methyl [4-({3-[(3,4-dimethylphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(2-fluorophenyl)methyl]amino)phenyl]acetate
Chemical Structure Depiction of
methyl [4-({3-[(3,4-dimethylphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(2-fluorophenyl)methyl]amino)phenyl]acetate
methyl [4-({3-[(3,4-dimethylphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(2-fluorophenyl)methyl]amino)phenyl]acetate
Compound characteristics
| Compound ID: | K784-5076 |
| Compound Name: | methyl [4-({3-[(3,4-dimethylphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(2-fluorophenyl)methyl]amino)phenyl]acetate |
| Molecular Weight: | 578.64 |
| Molecular Formula: | C31 H28 F2 N2 O5 S |
| Smiles: | Cc1ccc(cc1C)NC(c1cc(ccc1F)S(N(Cc1ccccc1F)c1ccc(CC(=O)OC)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5227 |
| logD: | 6.5211 |
| logSw: | -5.6844 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.462 |
| InChI Key: | RBJHQJFRXBGSET-UHFFFAOYSA-N |