4-[({3-[(2,4-dichlorophenoxy)methyl]-4-methoxyphenyl}methylidene)amino]-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-[({3-[(2,4-dichlorophenoxy)methyl]-4-methoxyphenyl}methylidene)amino]-4H-1,2,4-triazole-3-thiol
4-[({3-[(2,4-dichlorophenoxy)methyl]-4-methoxyphenyl}methylidene)amino]-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y502-5646 |
| Compound Name: | 4-[({3-[(2,4-dichlorophenoxy)methyl]-4-methoxyphenyl}methylidene)amino]-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 409.29 |
| Molecular Formula: | C17 H14 Cl2 N4 O2 S |
| Smiles: | COc1ccc(/C=N/n2cnnc2S)cc1COc1ccc(cc1[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.4476 |
| logD: | 3.4043 |
| logSw: | -3.848 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.332 |
| InChI Key: | HONYCVFIBXTPHR-UHFFFAOYSA-N |