N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 4715-0106 |
| Compound Name: | N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 548.64 |
| Molecular Formula: | C25 H24 N8 O3 S2 |
| Smiles: | CCn1c2ccccc2c2c1nc(nn2)SCC(Nc1ccc(cc1)S(Nc1nc(C)cc(C)n1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2293 |
| logD: | 2.7471 |
| logSw: | -3.4683 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 115.82 |
| InChI Key: | SNENOCAZWRPCBD-UHFFFAOYSA-N |