8-ethyl-8-methyl-3-phenyl-2-[(prop-2-en-1-yl)sulfanyl]-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
8-ethyl-8-methyl-3-phenyl-2-[(prop-2-en-1-yl)sulfanyl]-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
8-ethyl-8-methyl-3-phenyl-2-[(prop-2-en-1-yl)sulfanyl]-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | 8640-0380 |
| Compound Name: | 8-ethyl-8-methyl-3-phenyl-2-[(prop-2-en-1-yl)sulfanyl]-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 393.51 |
| Molecular Formula: | C22 H23 N3 O2 S |
| Smiles: | CCC1(C)Cc2c(CO1)cc1C(N(C(=Nc1n2)SCC=C)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6243 |
| logD: | 4.6226 |
| logSw: | -4.5413 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.936 |
| InChI Key: | RBTHLMWTIAPHGS-QFIPXVFZSA-N |