N'-cyclohexyl-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-N-(oxan-4-yl)urea
Chemical Structure Depiction of
N'-cyclohexyl-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-N-(oxan-4-yl)urea
N'-cyclohexyl-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-N-(oxan-4-yl)urea
Compound characteristics
| Compound ID: | SC12-0013 |
| Compound Name: | N'-cyclohexyl-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-N-(oxan-4-yl)urea |
| Molecular Weight: | 399.58 |
| Molecular Formula: | C24 H37 N3 O2 |
| Smiles: | C1CCC(CC1)NC(N(CCCN1CCc2ccccc2C1)C1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1956 |
| logD: | 3.411 |
| logSw: | -4.0321 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.822 |
| InChI Key: | WKBSAGCGGMGLEX-UHFFFAOYSA-N |