dimethyl N-{4-[2-(trifluoromethoxy)phenyl]-3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridine-5-carbonyl}aspartate
Chemical Structure Depiction of
dimethyl N-{4-[2-(trifluoromethoxy)phenyl]-3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridine-5-carbonyl}aspartate
dimethyl N-{4-[2-(trifluoromethoxy)phenyl]-3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridine-5-carbonyl}aspartate
Compound characteristics
| Compound ID: | Y043-7691 |
| Compound Name: | dimethyl N-{4-[2-(trifluoromethoxy)phenyl]-3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridine-5-carbonyl}aspartate |
| Molecular Weight: | 470.4 |
| Molecular Formula: | C20 H21 F3 N4 O6 |
| Smiles: | COC(C[C@@H](C(=O)OC)NC(N1CCc2c(C1c1ccccc1OC(F)(F)F)[nH]cn2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.5873 |
| logD: | 2.5868 |
| logSw: | -3.0654 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.873 |
| InChI Key: | QIMBSVKKIORREB-CWQZNGJJSA-N |