ethyl 2-({3-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]piperidine-1-carbonyl}amino)benzoate
Chemical Structure Depiction of
ethyl 2-({3-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]piperidine-1-carbonyl}amino)benzoate
ethyl 2-({3-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]piperidine-1-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | E632-2255 |
| Compound Name: | ethyl 2-({3-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]piperidine-1-carbonyl}amino)benzoate |
| Molecular Weight: | 421.54 |
| Molecular Formula: | C25 H31 N3 O3 |
| Smiles: | CCOC(c1ccccc1NC(N1CCCC(CN2CCc3ccccc3C2)C1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6986 |
| logD: | 4.3766 |
| logSw: | -4.3804 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.091 |
| InChI Key: | WYKSEOCUVNJMSC-LJQANCHMSA-N |