N-(4-chlorophenyl)-2-methyl-N-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-2-methyl-N-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide
N-(4-chlorophenyl)-2-methyl-N-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E857-2592 |
| Compound Name: | N-(4-chlorophenyl)-2-methyl-N-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 430.95 |
| Molecular Formula: | C22 H23 Cl N2 O3 S |
| Smiles: | CC1=C(C(N(CC(NCc2ccc(C)cc2)=O)c2ccc(cc2)[Cl])=O)SCCO1 |
| Stereo: | ACHIRAL |
| logP: | 3.5827 |
| logD: | 3.5827 |
| logSw: | -3.901 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.332 |
| InChI Key: | ZSFSVGDBFWODMU-UHFFFAOYSA-N |