N-(3-chloro-2-methylphenyl)-2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
N-(3-chloro-2-methylphenyl)-2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C201-1223 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 443.98 |
| Molecular Formula: | C20 H18 Cl N5 O S2 |
| Smiles: | Cc1c(cccc1[Cl])NC(CSc1nnc2c3c4CCCCc4sc3N=Cn12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2725 |
| logD: | 4.2723 |
| logSw: | -4.6379 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.286 |
| InChI Key: | GKUOWYKTVNWTOJ-UHFFFAOYSA-N |