2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-1-(prop-2-en-1-yl)pyrido[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-1-(prop-2-en-1-yl)pyrido[2,3-d]pyrimidin-4(1H)-one
2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-1-(prop-2-en-1-yl)pyrido[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | G749-0364 |
| Compound Name: | 2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-1-(prop-2-en-1-yl)pyrido[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 392.48 |
| Molecular Formula: | C21 H20 N4 O2 S |
| Smiles: | C=CCN1C(=NC(c2cccnc12)=O)SCC(N1CCCc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0227 |
| logD: | 3.0227 |
| logSw: | -3.5505 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.146 |
| InChI Key: | XXTPMJGHBYPOHI-UHFFFAOYSA-N |