2-[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazine-1-sulfonyl]benzonitrile
Chemical Structure Depiction of
2-[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazine-1-sulfonyl]benzonitrile
2-[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazine-1-sulfonyl]benzonitrile
Compound characteristics
| Compound ID: | V028-8399 |
| Compound Name: | 2-[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazine-1-sulfonyl]benzonitrile |
| Molecular Weight: | 495.56 |
| Molecular Formula: | C26 H21 N7 O2 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN1c1nc2ccccc2c2nnc(c3ccccc3)n12)S(c1ccccc1C#N)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1452 |
| logD: | 4.0841 |
| logSw: | -4.3227 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 81.568 |
| InChI Key: | AKSCCUVQOLQATI-UHFFFAOYSA-N |