[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]acetonitrile
Chemical Structure Depiction of
[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]acetonitrile
[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]acetonitrile
Compound characteristics
| Compound ID: | J084-0333 |
| Compound Name: | [(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]acetonitrile |
| Molecular Weight: | 317.37 |
| Molecular Formula: | C17 H11 N5 S |
| Smiles: | C(C#N)Sc1nnc2c3ccccc3nc(c3ccccc3)n12 |
| Stereo: | ACHIRAL |
| logP: | 3.3437 |
| logD: | 3.3289 |
| logSw: | -3.4287 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.074 |
| InChI Key: | QUVQLLQLFKXTQO-UHFFFAOYSA-N |