N-[4-(3,4-dihydroisoquinolin-2(1H)-yl)-3-(pyrrolidine-1-carbonyl)phenyl]-N'-(3,5-dimethoxyphenyl)urea
Chemical Structure Depiction of
N-[4-(3,4-dihydroisoquinolin-2(1H)-yl)-3-(pyrrolidine-1-carbonyl)phenyl]-N'-(3,5-dimethoxyphenyl)urea
N-[4-(3,4-dihydroisoquinolin-2(1H)-yl)-3-(pyrrolidine-1-carbonyl)phenyl]-N'-(3,5-dimethoxyphenyl)urea
Compound characteristics
| Compound ID: | V010-9985 |
| Compound Name: | N-[4-(3,4-dihydroisoquinolin-2(1H)-yl)-3-(pyrrolidine-1-carbonyl)phenyl]-N'-(3,5-dimethoxyphenyl)urea |
| Molecular Weight: | 500.6 |
| Molecular Formula: | C29 H32 N4 O4 |
| Salt: | not_available |
| Smiles: | COc1cc(cc(c1)OC)NC(Nc1ccc(c(c1)C(N1CCCC1)=O)N1CCc2ccccc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6121 |
| logD: | 5.612 |
| logSw: | -5.3974 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.457 |
| InChI Key: | PGXDBZNMNMIOBD-UHFFFAOYSA-N |