8-methyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
Chemical Structure Depiction of
8-methyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
8-methyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
Compound characteristics
| Compound ID: | E475-0631 |
| Compound Name: | 8-methyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide |
| Molecular Weight: | 380.46 |
| Molecular Formula: | C21 H20 N2 O3 S |
| Smiles: | Cc1ccc2c(c1)c1c(CO2)c(C(NCCc2ccc(cc2)SC)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.0368 |
| logD: | 4.0368 |
| logSw: | -4.2522 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.023 |
| InChI Key: | LHXOSRCAPIOAOK-UHFFFAOYSA-N |