N-[5-(diethylcarbamoyl)-2-methylphenyl]-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
N-[5-(diethylcarbamoyl)-2-methylphenyl]-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
N-[5-(diethylcarbamoyl)-2-methylphenyl]-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E532-1153 |
| Compound Name: | N-[5-(diethylcarbamoyl)-2-methylphenyl]-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 348.46 |
| Molecular Formula: | C18 H24 N2 O3 S |
| Smiles: | CCN(CC)C(c1ccc(C)c(c1)NC(C1=C(C)OCCS1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4865 |
| logD: | 1.4843 |
| logSw: | -2.6965 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.834 |
| InChI Key: | FFVCSHUPFKKBEL-UHFFFAOYSA-N |