2-amino-6-cyclopropyl-5-(3-nitro-1H-1,2,4-triazol-1-yl)-4-phenyl-4H-pyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-6-cyclopropyl-5-(3-nitro-1H-1,2,4-triazol-1-yl)-4-phenyl-4H-pyran-3-carbonitrile
2-amino-6-cyclopropyl-5-(3-nitro-1H-1,2,4-triazol-1-yl)-4-phenyl-4H-pyran-3-carbonitrile
Compound characteristics
| Compound ID: | 8009-4388 |
| Compound Name: | 2-amino-6-cyclopropyl-5-(3-nitro-1H-1,2,4-triazol-1-yl)-4-phenyl-4H-pyran-3-carbonitrile |
| Molecular Weight: | 350.33 |
| Molecular Formula: | C17 H14 N6 O3 |
| Smiles: | C1CC1C1=C(C(C(C#N)=C(N)O1)c1ccccc1)n1cnc(n1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0745 |
| logD: | 2.0745 |
| logSw: | -2.3455 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.062 |
| InChI Key: | OEDYYQHGIJJMQT-ZDUSSCGKSA-N |