2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-nitro-1,3-thiazol-2-yl)acetamide
Chemical Structure Depiction of
2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-nitro-1,3-thiazol-2-yl)acetamide
2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-nitro-1,3-thiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | 8007-4272 |
| Compound Name: | 2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-nitro-1,3-thiazol-2-yl)acetamide |
| Molecular Weight: | 401.42 |
| Molecular Formula: | C15 H11 N7 O3 S2 |
| Smiles: | Cn1c2ccccc2c2c1nc(nn2)SCC(Nc1ncc([N+]([O-])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8135 |
| logD: | 2.0636 |
| logSw: | -3.1976 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.239 |
| InChI Key: | QBGLNCGJXAWAAB-UHFFFAOYSA-N |