methyl N-{4-[2-(trifluoromethoxy)phenyl]-3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridine-5-carbonyl}alaninate
Chemical Structure Depiction of
methyl N-{4-[2-(trifluoromethoxy)phenyl]-3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridine-5-carbonyl}alaninate
methyl N-{4-[2-(trifluoromethoxy)phenyl]-3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridine-5-carbonyl}alaninate
Compound characteristics
| Compound ID: | Y043-7663 |
| Compound Name: | methyl N-{4-[2-(trifluoromethoxy)phenyl]-3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridine-5-carbonyl}alaninate |
| Molecular Weight: | 412.37 |
| Molecular Formula: | C18 H19 F3 N4 O4 |
| Smiles: | C[C@@H](C(=O)OC)NC(N1CCc2c(C1c1ccccc1OC(F)(F)F)[nH]cn2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2076 |
| logD: | 3.207 |
| logSw: | -3.7097 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.826 |
| InChI Key: | IPAVPKRJBGQTJI-MYHCZTBNSA-N |