N-(4-nitrophenyl)-2-[(2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-nitrophenyl)-2-[(2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide
N-(4-nitrophenyl)-2-[(2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C683-0035 |
| Compound Name: | N-(4-nitrophenyl)-2-[(2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 470.51 |
| Molecular Formula: | C25 H18 N4 O4 S |
| Smiles: | C1c2ccccc2Oc2c1c(nc(c1ccccc1)n2)SCC(Nc1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4919 |
| logD: | 6.4889 |
| logSw: | -6.1596 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.661 |
| InChI Key: | ZONNKOYQUQKNSK-UHFFFAOYSA-N |