N-(3-chloro-2-methylphenyl)-2-{[8-(dimethylsulfamoyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-{[8-(dimethylsulfamoyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetamide
N-(3-chloro-2-methylphenyl)-2-{[8-(dimethylsulfamoyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | K781-6278 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-{[8-(dimethylsulfamoyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 490.99 |
| Molecular Formula: | C20 H19 Cl N6 O3 S2 |
| Smiles: | Cc1c(cccc1[Cl])NC(CSc1nc2c(c3cc(ccc3[nH]2)S(N(C)C)(=O)=O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9659 |
| logD: | 2.9656 |
| logSw: | -3.565 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.65 |
| InChI Key: | GHABUEULPLVFMI-UHFFFAOYSA-N |