N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-N'-(3,4-dimethoxyphenyl)urea
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-N'-(3,4-dimethoxyphenyl)urea
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-N'-(3,4-dimethoxyphenyl)urea
Compound characteristics
Compound ID: | D216-2154 |
Compound Name: | N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-N'-(3,4-dimethoxyphenyl)urea |
Molecular Weight: | 355.44 |
Molecular Formula: | C20 H25 N3 O3 |
Smiles: | COc1ccc(cc1OC)NC(NCCN1CCc2ccccc2C1)=O |
Stereo: | ACHIRAL |
logP: | 2.7936 |
logD: | 1.2331 |
logSw: | -3.3117 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 52.61 |
InChI Key: | FFXRINGEBDAYAZ-UHFFFAOYSA-N |