2-{[5-(4-chloro-1-ethyl-1H-pyrazol-3-yl)-4-cyclopropyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methylpropyl)acetamide
Chemical Structure Depiction of
2-{[5-(4-chloro-1-ethyl-1H-pyrazol-3-yl)-4-cyclopropyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methylpropyl)acetamide
2-{[5-(4-chloro-1-ethyl-1H-pyrazol-3-yl)-4-cyclopropyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methylpropyl)acetamide
Compound characteristics
| Compound ID: | Y503-3750 |
| Compound Name: | 2-{[5-(4-chloro-1-ethyl-1H-pyrazol-3-yl)-4-cyclopropyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methylpropyl)acetamide |
| Molecular Weight: | 382.91 |
| Molecular Formula: | C16 H23 Cl N6 O S |
| Smiles: | CCn1cc(c(c2nnc(n2C2CC2)SCC(NCC(C)C)=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.1854 |
| logD: | 2.1854 |
| logSw: | -2.9856 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.668 |
| InChI Key: | WGGXCYQZRUGGRQ-UHFFFAOYSA-N |