N-butyl-4-(2-{[2-(2-cyanoanilino)-2-oxoethyl]sulfanyl}-1H-imidazol-1-yl)benzamide
Chemical Structure Depiction of
N-butyl-4-(2-{[2-(2-cyanoanilino)-2-oxoethyl]sulfanyl}-1H-imidazol-1-yl)benzamide
N-butyl-4-(2-{[2-(2-cyanoanilino)-2-oxoethyl]sulfanyl}-1H-imidazol-1-yl)benzamide
Compound characteristics
| Compound ID: | F984-0918 |
| Compound Name: | N-butyl-4-(2-{[2-(2-cyanoanilino)-2-oxoethyl]sulfanyl}-1H-imidazol-1-yl)benzamide |
| Molecular Weight: | 433.53 |
| Molecular Formula: | C23 H23 N5 O2 S |
| Smiles: | CCCCNC(c1ccc(cc1)n1ccnc1SCC(Nc1ccccc1C#N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1314 |
| logD: | 3.1296 |
| logSw: | -3.6577 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.552 |
| InChI Key: | UGONILUPMAHKQM-UHFFFAOYSA-N |