N-(5-{[2-(3,4-diethoxyphenyl)ethyl]carbamoyl}-2-methylphenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-(5-{[2-(3,4-diethoxyphenyl)ethyl]carbamoyl}-2-methylphenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-(5-{[2-(3,4-diethoxyphenyl)ethyl]carbamoyl}-2-methylphenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-1554 |
| Compound Name: | N-(5-{[2-(3,4-diethoxyphenyl)ethyl]carbamoyl}-2-methylphenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 470.59 |
| Molecular Formula: | C25 H30 N2 O5 S |
| Smiles: | CCOc1ccc(CCNC(c2ccc(C)c(c2)NC(C2=CSCCO2)=O)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 2.5867 |
| logD: | 2.5815 |
| logSw: | -3.0254 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.936 |
| InChI Key: | CLAJABRYGJGBPR-UHFFFAOYSA-N |