N-(5-chloro-2,4-dimethoxyphenyl)-N-methyl-4H-[1]benzothiopyrano[3,4-d][1,2]oxazole-3-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-N-methyl-4H-[1]benzothiopyrano[3,4-d][1,2]oxazole-3-carboxamide
N-(5-chloro-2,4-dimethoxyphenyl)-N-methyl-4H-[1]benzothiopyrano[3,4-d][1,2]oxazole-3-carboxamide
Compound characteristics
Compound ID: | E146-0912 |
Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-N-methyl-4H-[1]benzothiopyrano[3,4-d][1,2]oxazole-3-carboxamide |
Molecular Weight: | 416.88 |
Molecular Formula: | C20 H17 Cl N2 O4 S |
Smiles: | CN(C(c1c2CSc3ccccc3c2on1)=O)c1cc(c(cc1OC)OC)[Cl] |
Stereo: | ACHIRAL |
logP: | 4.3071 |
logD: | 4.3071 |
logSw: | -4.5495 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 52.648 |
InChI Key: | JMWSQBOTGDGENH-UHFFFAOYSA-N |