4-amino-5-(5-chloro-2-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-amino-5-(5-chloro-2-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
4-amino-5-(5-chloro-2-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8019-7371 |
| Compound Name: | 4-amino-5-(5-chloro-2-methoxyphenyl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 256.71 |
| Molecular Formula: | C9 H9 Cl N4 O S |
| Smiles: | COc1ccc(cc1c1nnc(n1N)S)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.3576 |
| logD: | 0.3937 |
| logSw: | -2.6268 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 48.515 |
| InChI Key: | RIGKHYQZOWIXJP-UHFFFAOYSA-N |