N-(5-chloro-2,4-dimethoxyphenyl)-2-({8-[(propan-2-yl)sulfamoyl]-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-2-({8-[(propan-2-yl)sulfamoyl]-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)acetamide
N-(5-chloro-2,4-dimethoxyphenyl)-2-({8-[(propan-2-yl)sulfamoyl]-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | K781-1728 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-2-({8-[(propan-2-yl)sulfamoyl]-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 551.04 |
| Molecular Formula: | C22 H23 Cl N6 O5 S2 |
| Smiles: | CC(C)NS(c1ccc2c(c1)c1c(nc(nn1)SCC(Nc1cc(c(cc1OC)OC)[Cl])=O)[nH]2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9689 |
| logD: | 2.9612 |
| logSw: | -3.5846 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 120.464 |
| InChI Key: | NUGNHWUZYUIOGR-UHFFFAOYSA-N |