6,8,8,9-tetramethyl-3-{[(4-methylpyrimidin-2-yl)sulfanyl]acetyl}-8,9-dihydro-2H-pyrano[3,2-g]quinolin-2-one
Chemical Structure Depiction of
6,8,8,9-tetramethyl-3-{[(4-methylpyrimidin-2-yl)sulfanyl]acetyl}-8,9-dihydro-2H-pyrano[3,2-g]quinolin-2-one
6,8,8,9-tetramethyl-3-{[(4-methylpyrimidin-2-yl)sulfanyl]acetyl}-8,9-dihydro-2H-pyrano[3,2-g]quinolin-2-one
Compound characteristics
| Compound ID: | Y021-1024 |
| Compound Name: | 6,8,8,9-tetramethyl-3-{[(4-methylpyrimidin-2-yl)sulfanyl]acetyl}-8,9-dihydro-2H-pyrano[3,2-g]quinolin-2-one |
| Molecular Weight: | 421.52 |
| Molecular Formula: | C23 H23 N3 O3 S |
| Smiles: | CC1=CC(C)(C)N(C)c2cc3c(C=C(C(CSc4nccc(C)n4)=O)C(=O)O3)cc12 |
| Stereo: | ACHIRAL |
| logP: | 4.1572 |
| logD: | 4.1572 |
| logSw: | -4.4167 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.206 |
| InChI Key: | CZHJIMXLAXTYPZ-UHFFFAOYSA-N |