N-(3-methylphenyl)-2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-methylphenyl)-2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
N-(3-methylphenyl)-2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 4570-0002 |
| Compound Name: | N-(3-methylphenyl)-2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 363.44 |
| Molecular Formula: | C19 H17 N5 O S |
| Smiles: | Cc1cccc(c1)NC(CSc1nc2c(c3ccccc3n2C)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3613 |
| logD: | 3.3613 |
| logSw: | -3.6037 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.938 |
| InChI Key: | ARRYCSPPFAPDMF-UHFFFAOYSA-N |