2-methyl-N-(2-methyl-5-{[(4-propoxyphenyl)methyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
2-methyl-N-(2-methyl-5-{[(4-propoxyphenyl)methyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide
2-methyl-N-(2-methyl-5-{[(4-propoxyphenyl)methyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
Compound ID: | E532-1410 |
Compound Name: | 2-methyl-N-(2-methyl-5-{[(4-propoxyphenyl)methyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide |
Molecular Weight: | 440.56 |
Molecular Formula: | C24 H28 N2 O4 S |
Smiles: | CCCOc1ccc(CNC(c2ccc(C)c(c2)NC(C2=C(C)OCCS2)=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.4642 |
logD: | 3.4524 |
logSw: | -3.6337 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 62.734 |
InChI Key: | FGWRFXIMWCZILM-UHFFFAOYSA-N |