2-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
2-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-7847 |
| Compound Name: | 2-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 460.5 |
| Molecular Formula: | C23 H22 F2 N2 O4 S |
| Smiles: | CCNC(N(Cc1ccc(cc1)F)Cc1ccccc1OS(c1ccc(cc1)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3192 |
| logD: | 4.3192 |
| logSw: | -4.2418 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.066 |
| InChI Key: | UJXSNGGRTLXGFU-UHFFFAOYSA-N |