3-{[(4-butoxyphenyl)methyl]sulfanyl}-5-methyl-4H-1,2,4-triazol-4-amine
Chemical Structure Depiction of
3-{[(4-butoxyphenyl)methyl]sulfanyl}-5-methyl-4H-1,2,4-triazol-4-amine
3-{[(4-butoxyphenyl)methyl]sulfanyl}-5-methyl-4H-1,2,4-triazol-4-amine
Compound characteristics
| Compound ID: | 4298-0299 |
| Compound Name: | 3-{[(4-butoxyphenyl)methyl]sulfanyl}-5-methyl-4H-1,2,4-triazol-4-amine |
| Molecular Weight: | 292.4 |
| Molecular Formula: | C14 H20 N4 O S |
| Smiles: | CCCCOc1ccc(CSc2nnc(C)n2N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.2749 |
| logD: | 2.2749 |
| logSw: | -2.4139 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.606 |
| InChI Key: | QYTQEHVLDNXBDY-UHFFFAOYSA-N |