2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[2-(pyridin-2-yl)ethyl]acetamide
Chemical Structure Depiction of
2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[2-(pyridin-2-yl)ethyl]acetamide
2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[2-(pyridin-2-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | V029-7439 |
| Compound Name: | 2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[2-(pyridin-2-yl)ethyl]acetamide |
| Molecular Weight: | 454.55 |
| Molecular Formula: | C25 H22 N6 O S |
| Salt: | not_available |
| Smiles: | C(CNC(CSc1nc2c(c3ccccc3n2Cc2ccccc2)nn1)=O)c1ccccn1 |
| Stereo: | ACHIRAL |
| logP: | 3.4239 |
| logD: | 3.4191 |
| logSw: | -3.6789 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.563 |
| InChI Key: | BLLJVZNWRJUNCM-UHFFFAOYSA-N |