(3-phenyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-5-yl)[4-(propan-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-(propan-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-(propan-2-yl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | T149-0992 |
| Compound Name: | (3-phenyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-5-yl)[4-(propan-2-yl)piperazin-1-yl]methanone |
| Molecular Weight: | 367.49 |
| Molecular Formula: | C21 H29 N5 O |
| Smiles: | CC(C)N1CCN(CC1)C(C1CCCCc2nnc(c3ccccc3)n12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2137 |
| logD: | 1.759 |
| logSw: | -2.2343 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.774 |
| InChI Key: | HQYULECTFBHXPV-SFHVURJKSA-N |