N-(2-chloro-5-methoxy-4-{[(4-methylphenyl)methyl]carbamoyl}phenyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
N-(2-chloro-5-methoxy-4-{[(4-methylphenyl)methyl]carbamoyl}phenyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
N-(2-chloro-5-methoxy-4-{[(4-methylphenyl)methyl]carbamoyl}phenyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E532-2835 |
| Compound Name: | N-(2-chloro-5-methoxy-4-{[(4-methylphenyl)methyl]carbamoyl}phenyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 446.95 |
| Molecular Formula: | C22 H23 Cl N2 O4 S |
| Smiles: | CC1=C(C(Nc2cc(c(cc2[Cl])C(NCc2ccc(C)cc2)=O)OC)=O)SCCO1 |
| Stereo: | ACHIRAL |
| logP: | 4.2643 |
| logD: | 1.3838 |
| logSw: | -4.5148 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.946 |
| InChI Key: | SKRVWICFKYLHEB-UHFFFAOYSA-N |