2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-1-phenylethan-1-one
Chemical Structure Depiction of
2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-1-phenylethan-1-one
2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-1-phenylethan-1-one
Compound characteristics
| Compound ID: | 8006-2708 |
| Compound Name: | 2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-1-phenylethan-1-one |
| Molecular Weight: | 334.4 |
| Molecular Formula: | C18 H14 N4 O S |
| Smiles: | Cn1c2ccccc2c2c1nc(nn2)SCC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0236 |
| logD: | 3.0236 |
| logSw: | -3.2085 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.035 |
| InChI Key: | ABAGGBKZOHKLKE-UHFFFAOYSA-N |