3-cyclopropyl-5-{[(4-nitro-1H-pyrazol-1-yl)methyl]sulfanyl}-4-propyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-cyclopropyl-5-{[(4-nitro-1H-pyrazol-1-yl)methyl]sulfanyl}-4-propyl-4H-1,2,4-triazole
3-cyclopropyl-5-{[(4-nitro-1H-pyrazol-1-yl)methyl]sulfanyl}-4-propyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y202-8132 |
| Compound Name: | 3-cyclopropyl-5-{[(4-nitro-1H-pyrazol-1-yl)methyl]sulfanyl}-4-propyl-4H-1,2,4-triazole |
| Molecular Weight: | 308.36 |
| Molecular Formula: | C12 H16 N6 O2 S |
| Smiles: | CCCn1c(C2CC2)nnc1SCn1cc(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.1311 |
| logD: | 2.1258 |
| logSw: | -1.9018 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.029 |
| InChI Key: | FWRBZUBBNDDUSL-UHFFFAOYSA-N |