(3-phenyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-5-yl)[4-(pyridin-2-yl)piperazin-1-yl]methanone
Chemical Structure Depiction of
(3-phenyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-5-yl)[4-(pyridin-2-yl)piperazin-1-yl]methanone
(3-phenyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-5-yl)[4-(pyridin-2-yl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | T149-0851 |
| Compound Name: | (3-phenyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-5-yl)[4-(pyridin-2-yl)piperazin-1-yl]methanone |
| Molecular Weight: | 402.5 |
| Molecular Formula: | C23 H26 N6 O |
| Smiles: | C1CCc2nnc(c3ccccc3)n2C(C1)C(N1CCN(CC1)c1ccccn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8627 |
| logD: | 2.8538 |
| logSw: | -3.0011 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.682 |
| InChI Key: | GSZXZODTFAFYGR-IBGZPJMESA-N |