(4-methylpiperazin-1-yl)(3-phenyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-5-yl)methanone
Chemical Structure Depiction of
(4-methylpiperazin-1-yl)(3-phenyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-5-yl)methanone
(4-methylpiperazin-1-yl)(3-phenyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-5-yl)methanone
Compound characteristics
| Compound ID: | T149-0845 |
| Compound Name: | (4-methylpiperazin-1-yl)(3-phenyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-5-yl)methanone |
| Molecular Weight: | 339.44 |
| Molecular Formula: | C19 H25 N5 O |
| Smiles: | CN1CCN(CC1)C(C1CCCCc2nnc(c3ccccc3)n12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3779 |
| logD: | 1.1838 |
| logSw: | -1.7741 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.387 |
| InChI Key: | NJDXIFCOOIPRBG-INIZCTEOSA-N |