N-(4-chlorophenyl)-N-(2-{[(4-ethoxy-3-methoxyphenyl)methyl]amino}-2-oxoethyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-N-(2-{[(4-ethoxy-3-methoxyphenyl)methyl]amino}-2-oxoethyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
N-(4-chlorophenyl)-N-(2-{[(4-ethoxy-3-methoxyphenyl)methyl]amino}-2-oxoethyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E857-2783 |
| Compound Name: | N-(4-chlorophenyl)-N-(2-{[(4-ethoxy-3-methoxyphenyl)methyl]amino}-2-oxoethyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 491.01 |
| Molecular Formula: | C24 H27 Cl N2 O5 S |
| Smiles: | CCOc1ccc(CNC(CN(C(C2=C(C)OCCS2)=O)c2ccc(cc2)[Cl])=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.1198 |
| logD: | 3.1198 |
| logSw: | -3.5279 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.172 |
| InChI Key: | NYLXVYYNCJRZIP-UHFFFAOYSA-N |