N-(7-hydroxy-5-methyl-2-propyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-4-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-(7-hydroxy-5-methyl-2-propyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-4-nitrobenzene-1-sulfonamide
N-(7-hydroxy-5-methyl-2-propyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-4-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | C301-4387 |
| Compound Name: | N-(7-hydroxy-5-methyl-2-propyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-4-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 392.39 |
| Molecular Formula: | C15 H16 N6 O5 S |
| Smiles: | CCCc1nc2nc(C)c(c(n2n1)O)NS(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3675 |
| logD: | -1.0985 |
| logSw: | -2.3984 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 120.434 |
| InChI Key: | VTPKLXWUWLEORM-UHFFFAOYSA-N |