N-ethyl-N'-(1-{2-[(3-fluorophenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}ethyl)urea
Chemical Structure Depiction of
N-ethyl-N'-(1-{2-[(3-fluorophenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}ethyl)urea
N-ethyl-N'-(1-{2-[(3-fluorophenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}ethyl)urea
Compound characteristics
| Compound ID: | V028-4841 |
| Compound Name: | N-ethyl-N'-(1-{2-[(3-fluorophenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}ethyl)urea |
| Molecular Weight: | 415.51 |
| Molecular Formula: | C23 H30 F N3 O3 |
| Salt: | not_available |
| Smiles: | CCNC(NC(C)C1c2cc(c(cc2CCN1Cc1cccc(c1)F)OC)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.8427 |
| logD: | 0.896 |
| logSw: | -3.3322 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.651 |
| InChI Key: | GDBRGBITWYMNJD-UHFFFAOYSA-N |