({4-amino-5-[3-(benzyloxy)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetonitrile
Chemical Structure Depiction of
({4-amino-5-[3-(benzyloxy)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetonitrile
({4-amino-5-[3-(benzyloxy)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetonitrile
Compound characteristics
| Compound ID: | 8019-7336 |
| Compound Name: | ({4-amino-5-[3-(benzyloxy)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetonitrile |
| Molecular Weight: | 337.4 |
| Molecular Formula: | C17 H15 N5 O S |
| Smiles: | C(c1ccccc1)Oc1cccc(c1)c1nnc(n1N)SCC#N |
| Stereo: | ACHIRAL |
| logP: | 2.6361 |
| logD: | 2.6361 |
| logSw: | -3.0187 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.13 |
| InChI Key: | DZJGWFLOAODFBB-UHFFFAOYSA-N |