N-(2-{[2-(cyclopropylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methoxybenzamide
Chemical Structure Depiction of
N-(2-{[2-(cyclopropylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methoxybenzamide
N-(2-{[2-(cyclopropylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methoxybenzamide
Compound characteristics
| Compound ID: | 8008-9621 |
| Compound Name: | N-(2-{[2-(cyclopropylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methoxybenzamide |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C20 H19 N3 O3 S2 |
| Smiles: | COc1ccccc1C(Nc1ccc2c(c1)sc(n2)SCC(NC1CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5319 |
| logD: | 3.5205 |
| logSw: | -3.8889 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.298 |
| InChI Key: | IGKIPQAYOQDQFB-UHFFFAOYSA-N |