N-{1-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl]piperidin-4-yl}-N'-(prop-2-en-1-yl)urea
Chemical Structure Depiction of
N-{1-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl]piperidin-4-yl}-N'-(prop-2-en-1-yl)urea
N-{1-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl]piperidin-4-yl}-N'-(prop-2-en-1-yl)urea
Compound characteristics
| Compound ID: | V026-6188 |
| Compound Name: | N-{1-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl]piperidin-4-yl}-N'-(prop-2-en-1-yl)urea |
| Molecular Weight: | 418.54 |
| Molecular Formula: | C25 H30 N4 O2 |
| Salt: | not_available |
| Smiles: | C=CCNC(NC1CCN(CC1)c1ccccc1C(N1CCc2ccccc2C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9936 |
| logD: | 2.9935 |
| logSw: | -3.5894 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.294 |
| InChI Key: | LIJDIFYTSDPKHT-UHFFFAOYSA-N |