N-(3-chloro-2-methylphenyl)-2-[(thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-[(thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
N-(3-chloro-2-methylphenyl)-2-[(thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | E513-0091 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-[(thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide |
| Molecular Weight: | 388.9 |
| Molecular Formula: | C17 H13 Cl N4 O S2 |
| Smiles: | Cc1c(cccc1[Cl])NC(CSc1c2cc3c(ccs3)n2cnn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7702 |
| logD: | 3.7694 |
| logSw: | -3.9718 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.395 |
| InChI Key: | CLVDOSCGOFMIOH-UHFFFAOYSA-N |