2-({7-methyl-2-[4-(methylsulfanyl)phenyl]-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl}sulfanyl)acetamide
Chemical Structure Depiction of
2-({7-methyl-2-[4-(methylsulfanyl)phenyl]-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl}sulfanyl)acetamide
2-({7-methyl-2-[4-(methylsulfanyl)phenyl]-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | C683-0685 |
| Compound Name: | 2-({7-methyl-2-[4-(methylsulfanyl)phenyl]-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl}sulfanyl)acetamide |
| Molecular Weight: | 409.53 |
| Molecular Formula: | C21 H19 N3 O2 S2 |
| Smiles: | Cc1ccc2c(Cc3c(nc(c4ccc(cc4)SC)nc3SCC(N)=O)O2)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.5143 |
| logD: | 5.5112 |
| logSw: | -5.4568 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.79 |
| InChI Key: | LSCHEIUMXPWKIK-UHFFFAOYSA-N |