N-(2-chlorophenyl)-2-[(9-methyl-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-chlorophenyl)-2-[(9-methyl-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide
N-(2-chlorophenyl)-2-[(9-methyl-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C683-0807 |
| Compound Name: | N-(2-chlorophenyl)-2-[(9-methyl-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 473.98 |
| Molecular Formula: | C26 H20 Cl N3 O2 S |
| Smiles: | Cc1cccc2Cc3c(nc(c4ccccc4)nc3SCC(Nc3ccccc3[Cl])=O)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 7.0692 |
| logD: | 7.0661 |
| logSw: | -6.2783 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.266 |
| InChI Key: | LXHCVURGNJXRQS-UHFFFAOYSA-N |