butyl 2-{2-[(2-cyanophenyl)sulfanyl]benzamido}benzoate
Chemical Structure Depiction of
butyl 2-{2-[(2-cyanophenyl)sulfanyl]benzamido}benzoate
butyl 2-{2-[(2-cyanophenyl)sulfanyl]benzamido}benzoate
Compound characteristics
| Compound ID: | 8015-1858 |
| Compound Name: | butyl 2-{2-[(2-cyanophenyl)sulfanyl]benzamido}benzoate |
| Molecular Weight: | 430.52 |
| Molecular Formula: | C25 H22 N2 O3 S |
| Smiles: | CCCCOC(c1ccccc1NC(c1ccccc1Sc1ccccc1C#N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0762 |
| logD: | 5.9855 |
| logSw: | -5.4707 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.464 |
| InChI Key: | FLUTWNFHMUHCKN-UHFFFAOYSA-N |