2-{[8,8-dimethyl-3-(3-methylphenyl)-4-oxo-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl]sulfanyl}-N-phenylacetamide
Chemical Structure Depiction of
2-{[8,8-dimethyl-3-(3-methylphenyl)-4-oxo-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl]sulfanyl}-N-phenylacetamide
2-{[8,8-dimethyl-3-(3-methylphenyl)-4-oxo-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl]sulfanyl}-N-phenylacetamide
Compound characteristics
| Compound ID: | 6280-0820 |
| Compound Name: | 2-{[8,8-dimethyl-3-(3-methylphenyl)-4-oxo-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl]sulfanyl}-N-phenylacetamide |
| Molecular Weight: | 486.59 |
| Molecular Formula: | C27 H26 N4 O3 S |
| Smiles: | Cc1cccc(c1)N1C(=Nc2c(cc3COC(C)(C)Cc3n2)C1=O)SCC(Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7659 |
| logD: | 4.7646 |
| logSw: | -4.6038 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.619 |
| InChI Key: | CFORMKRFAONFPL-UHFFFAOYSA-N |