N-benzyl-3-(2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-1H-imidazol-1-yl)benzamide
Chemical Structure Depiction of
N-benzyl-3-(2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-1H-imidazol-1-yl)benzamide
N-benzyl-3-(2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-1H-imidazol-1-yl)benzamide
Compound characteristics
| Compound ID: | F985-0069 |
| Compound Name: | N-benzyl-3-(2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-1H-imidazol-1-yl)benzamide |
| Molecular Weight: | 422.55 |
| Molecular Formula: | C23 H26 N4 O2 S |
| Smiles: | CCCCNC(CSc1nccn1c1cccc(c1)C(NCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3202 |
| logD: | 3.3108 |
| logSw: | -3.6228 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.515 |
| InChI Key: | TXFKKAXDSRQFBN-UHFFFAOYSA-N |