4-{[(3-methoxyphenyl)methylidene]amino}-5-phenyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-{[(3-methoxyphenyl)methylidene]amino}-5-phenyl-4H-1,2,4-triazole-3-thiol
4-{[(3-methoxyphenyl)methylidene]amino}-5-phenyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8007-4387 |
| Compound Name: | 4-{[(3-methoxyphenyl)methylidene]amino}-5-phenyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 310.38 |
| Molecular Formula: | C16 H14 N4 O S |
| Smiles: | COc1cccc(/C=N/n2c(c3ccccc3)nnc2S)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.072 |
| logD: | 2.0712 |
| logSw: | -3.2053 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.622 |
| InChI Key: | OTXIMGRGLLRPFF-UHFFFAOYSA-N |