4-({(2,3-dimethylphenyl)-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-({(2,3-dimethylphenyl)-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
4-({(2,3-dimethylphenyl)-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V014-1177 |
| Compound Name: | 4-({(2,3-dimethylphenyl)-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 536.6 |
| Molecular Formula: | C29 H26 F2 N2 O4 S |
| Smiles: | Cc1cccc(c1C)NC(N(Cc1ccc(cc1)OS(c1ccc(cc1)F)(=O)=O)Cc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4816 |
| logD: | 6.4816 |
| logSw: | -5.6963 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.062 |
| InChI Key: | RIRAESIPDJHNLT-UHFFFAOYSA-N |