2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}acetamide
Chemical Structure Depiction of
2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}acetamide
2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}acetamide
Compound characteristics
| Compound ID: | 5025-0055 |
| Compound Name: | 2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}acetamide |
| Molecular Weight: | 525.63 |
| Molecular Formula: | C22 H19 N7 O3 S3 |
| Smiles: | CCn1c2ccccc2c2c1nc(nn2)SCC(Nc1ccc(cc1)S(Nc1nccs1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4016 |
| logD: | 2.9918 |
| logSw: | -3.7259 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.98 |
| InChI Key: | OWVIDTLNJDCHFL-UHFFFAOYSA-N |