(3-phenyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-5-yl)(pyrrolidin-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)(pyrrolidin-1-yl)methanone
(3-phenyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-5-yl)(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | T149-1009 |
| Compound Name: | (3-phenyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-5-yl)(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 310.4 |
| Molecular Formula: | C18 H22 N4 O |
| Smiles: | C1CCc2nnc(c3ccccc3)n2C(C1)C(N1CCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3446 |
| logD: | 2.3439 |
| logSw: | -2.3559 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 43.276 |
| InChI Key: | HVKRAICFHCOYGG-HNNXBMFYSA-N |