3-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]-2-(3,5-dimethyl-1H-pyrazol-1-yl)-5-ethyl-6-methylpyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]-2-(3,5-dimethyl-1H-pyrazol-1-yl)-5-ethyl-6-methylpyrimidin-4(3H)-one
3-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]-2-(3,5-dimethyl-1H-pyrazol-1-yl)-5-ethyl-6-methylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | G953-0008 |
| Compound Name: | 3-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]-2-(3,5-dimethyl-1H-pyrazol-1-yl)-5-ethyl-6-methylpyrimidin-4(3H)-one |
| Molecular Weight: | 405.5 |
| Molecular Formula: | C23 H27 N5 O2 |
| Smiles: | CCC1=C(C)N=C(N(CC(N2CCCc3ccccc23)=O)C1=O)n1c(C)cc(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.0039 |
| logD: | 2.0039 |
| logSw: | -2.3116 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.95 |
| InChI Key: | PKDZTVMCOHRBOB-UHFFFAOYSA-N |