N-(2-chloro-4-{[(2,4-dimethoxyphenyl)methyl]carbamoyl}-5-methoxyphenyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-{[(2,4-dimethoxyphenyl)methyl]carbamoyl}-5-methoxyphenyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
N-(2-chloro-4-{[(2,4-dimethoxyphenyl)methyl]carbamoyl}-5-methoxyphenyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E532-2960 |
| Compound Name: | N-(2-chloro-4-{[(2,4-dimethoxyphenyl)methyl]carbamoyl}-5-methoxyphenyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 492.98 |
| Molecular Formula: | C23 H25 Cl N2 O6 S |
| Smiles: | CC1=C(C(Nc2cc(c(cc2[Cl])C(NCc2ccc(cc2OC)OC)=O)OC)=O)SCCO1 |
| Stereo: | ACHIRAL |
| logP: | 4.0606 |
| logD: | 1.1801 |
| logSw: | -4.4657 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.12 |
| InChI Key: | WITOXNHGLCPRRI-UHFFFAOYSA-N |