2-(3,4-dihydroisoquinolin-2(1H)-yl)-N-[(oxolan-2-yl)methyl]-5-(2-phenylacetamido)benzamide
Chemical Structure Depiction of
2-(3,4-dihydroisoquinolin-2(1H)-yl)-N-[(oxolan-2-yl)methyl]-5-(2-phenylacetamido)benzamide
2-(3,4-dihydroisoquinolin-2(1H)-yl)-N-[(oxolan-2-yl)methyl]-5-(2-phenylacetamido)benzamide
Compound characteristics
| Compound ID: | V011-2997 |
| Compound Name: | 2-(3,4-dihydroisoquinolin-2(1H)-yl)-N-[(oxolan-2-yl)methyl]-5-(2-phenylacetamido)benzamide |
| Molecular Weight: | 469.58 |
| Molecular Formula: | C29 H31 N3 O3 |
| Smiles: | C1CC(CNC(c2cc(ccc2N2CCc3ccccc3C2)NC(Cc2ccccc2)=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2288 |
| logD: | 4.2288 |
| logSw: | -4.3107 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.997 |
| InChI Key: | WCOVMZMTPKXTMS-RUZDIDTESA-N |