N-[4-(3,4-dihydroisoquinolin-2(1H)-yl)-3-(pyrrolidine-1-carbonyl)phenyl]-N'-(3-methylphenyl)urea
Chemical Structure Depiction of
N-[4-(3,4-dihydroisoquinolin-2(1H)-yl)-3-(pyrrolidine-1-carbonyl)phenyl]-N'-(3-methylphenyl)urea
N-[4-(3,4-dihydroisoquinolin-2(1H)-yl)-3-(pyrrolidine-1-carbonyl)phenyl]-N'-(3-methylphenyl)urea
Compound characteristics
| Compound ID: | V019-2758 |
| Compound Name: | N-[4-(3,4-dihydroisoquinolin-2(1H)-yl)-3-(pyrrolidine-1-carbonyl)phenyl]-N'-(3-methylphenyl)urea |
| Molecular Weight: | 454.57 |
| Molecular Formula: | C28 H30 N4 O2 |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)NC(Nc1ccc(c(c1)C(N1CCCC1)=O)N1CCc2ccccc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.833 |
| logD: | 5.833 |
| logSw: | -5.4373 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.369 |
| InChI Key: | PZCDEOKJBSBYRL-UHFFFAOYSA-N |