N-(4-chlorophenyl)-N-(2-{[(2,3-dimethoxyphenyl)methyl]amino}-2-oxoethyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-N-(2-{[(2,3-dimethoxyphenyl)methyl]amino}-2-oxoethyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
N-(4-chlorophenyl)-N-(2-{[(2,3-dimethoxyphenyl)methyl]amino}-2-oxoethyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E857-2717 |
| Compound Name: | N-(4-chlorophenyl)-N-(2-{[(2,3-dimethoxyphenyl)methyl]amino}-2-oxoethyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 476.98 |
| Molecular Formula: | C23 H25 Cl N2 O5 S |
| Smiles: | CC1=C(C(N(CC(NCc2cccc(c2OC)OC)=O)c2ccc(cc2)[Cl])=O)SCCO1 |
| Stereo: | ACHIRAL |
| logP: | 3.3002 |
| logD: | 3.3002 |
| logSw: | -3.6667 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.679 |
| InChI Key: | ZORHSUHPAGPEGP-UHFFFAOYSA-N |