N-(3,5-dimethylphenyl)-2-{[9-methyl-2-(4-methylphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-2-{[9-methyl-2-(4-methylphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
N-(3,5-dimethylphenyl)-2-{[9-methyl-2-(4-methylphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C683-0768 |
| Compound Name: | N-(3,5-dimethylphenyl)-2-{[9-methyl-2-(4-methylphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 481.62 |
| Molecular Formula: | C29 H27 N3 O2 S |
| Smiles: | Cc1ccc(cc1)c1nc2c(Cc3cccc(C)c3O2)c(n1)SCC(Nc1cc(C)cc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 8.2398 |
| logD: | 8.2368 |
| logSw: | -5.6232 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.964 |
| InChI Key: | OUCNBCONCIOMJG-UHFFFAOYSA-N |