2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-sulfamoylphenyl)butanamide
Chemical Structure Depiction of
2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-sulfamoylphenyl)butanamide
2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-sulfamoylphenyl)butanamide
Compound characteristics
| Compound ID: | 8009-1544 |
| Compound Name: | 2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-sulfamoylphenyl)butanamide |
| Molecular Weight: | 532.64 |
| Molecular Formula: | C26 H24 N6 O3 S2 |
| Smiles: | CCC(C(Nc1ccc(cc1)S(N)(=O)=O)=O)Sc1nc2c(c3ccccc3n2Cc2ccccc2)nn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1856 |
| logD: | 4.1843 |
| logSw: | -4.1947 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 106.673 |
| InChI Key: | AVSIAAHKDYPNSM-QFIPXVFZSA-N |