3-methyl-5-{[(4-propoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-4-amine
Chemical Structure Depiction of
3-methyl-5-{[(4-propoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-4-amine
3-methyl-5-{[(4-propoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-4-amine
Compound characteristics
| Compound ID: | 4298-0297 |
| Compound Name: | 3-methyl-5-{[(4-propoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-4-amine |
| Molecular Weight: | 278.37 |
| Molecular Formula: | C13 H18 N4 O S |
| Smiles: | CCCOc1ccc(CSc2nnc(C)n2N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.8019 |
| logD: | 1.8019 |
| logSw: | -2.0959 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.606 |
| InChI Key: | YPZAYLIZYIYABR-UHFFFAOYSA-N |