3-cyclopropyl-5-{[(2-methylphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-cyclopropyl-5-{[(2-methylphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
3-cyclopropyl-5-{[(2-methylphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V015-2261 |
| Compound Name: | 3-cyclopropyl-5-{[(2-methylphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole |
| Molecular Weight: | 321.44 |
| Molecular Formula: | C19 H19 N3 S |
| Salt: | not_available |
| Smiles: | Cc1ccccc1CSc1nnc(C2CC2)n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0776 |
| logD: | 5.0775 |
| logSw: | -4.8247 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.2357 |
| InChI Key: | IRLBRTNZDLDMIF-UHFFFAOYSA-N |