N-tert-butyl-N'-(1-{2-[(3-fluorophenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}ethyl)urea
Chemical Structure Depiction of
N-tert-butyl-N'-(1-{2-[(3-fluorophenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}ethyl)urea
N-tert-butyl-N'-(1-{2-[(3-fluorophenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}ethyl)urea
Compound characteristics
| Compound ID: | V014-2389 |
| Compound Name: | N-tert-butyl-N'-(1-{2-[(3-fluorophenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}ethyl)urea |
| Molecular Weight: | 443.56 |
| Molecular Formula: | C25 H34 F N3 O3 |
| Salt: | not_available |
| Smiles: | CC(C1c2cc(c(cc2CCN1Cc1cccc(c1)F)OC)OC)NC(NC(C)(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.681 |
| logD: | 1.7343 |
| logSw: | -3.9795 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.849 |
| InChI Key: | IJNZBJPTNIIBOY-UHFFFAOYSA-N |