2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-methylpyridin-2-yl)acetamide
Chemical Structure Depiction of
2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-methylpyridin-2-yl)acetamide
2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-methylpyridin-2-yl)acetamide
Compound characteristics
| Compound ID: | P160-0020 |
| Compound Name: | 2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-methylpyridin-2-yl)acetamide |
| Molecular Weight: | 440.53 |
| Molecular Formula: | C24 H20 N6 O S |
| Smiles: | Cc1ccnc(c1)NC(CSc1nc2c(c3ccccc3n2Cc2ccccc2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4025 |
| logD: | 4.4024 |
| logSw: | -4.2484 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.471 |
| InChI Key: | XAQKHBSJOQTCAV-UHFFFAOYSA-N |