3-(azepane-1-carbonyl)-6-phenyl[1,2,3]triazolo[1,5-a]pyrazin-4(5H)-one
Chemical Structure Depiction of
3-(azepane-1-carbonyl)-6-phenyl[1,2,3]triazolo[1,5-a]pyrazin-4(5H)-one
3-(azepane-1-carbonyl)-6-phenyl[1,2,3]triazolo[1,5-a]pyrazin-4(5H)-one
Compound characteristics
| Compound ID: | S437-0418 |
| Compound Name: | 3-(azepane-1-carbonyl)-6-phenyl[1,2,3]triazolo[1,5-a]pyrazin-4(5H)-one |
| Molecular Weight: | 337.38 |
| Molecular Formula: | C18 H19 N5 O2 |
| Smiles: | C1CCCN(CC1)C(c1c2C(NC(=Cn2nn1)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6606 |
| logD: | 0.7747 |
| logSw: | -2.1589 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.767 |
| InChI Key: | UTPVEWUUFVMISB-UHFFFAOYSA-N |