N-(2-{[2-(cyclopropylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(pyrrolidine-1-carbonyl)benzamide
Chemical Structure Depiction of
N-(2-{[2-(cyclopropylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(pyrrolidine-1-carbonyl)benzamide
N-(2-{[2-(cyclopropylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(pyrrolidine-1-carbonyl)benzamide
Compound characteristics
| Compound ID: | 8011-6228 |
| Compound Name: | N-(2-{[2-(cyclopropylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(pyrrolidine-1-carbonyl)benzamide |
| Molecular Weight: | 480.61 |
| Molecular Formula: | C24 H24 N4 O3 S2 |
| Smiles: | C1CCN(C1)C(c1ccccc1C(Nc1ccc2c(c1)sc(n2)SCC(NC1CC1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3497 |
| logD: | 3.3495 |
| logSw: | -3.819 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.682 |
| InChI Key: | YEXGQFFTIIAOHO-UHFFFAOYSA-N |