2-methyl-N-[4-(2-{[(2-methylphenyl)methyl]amino}-2-oxoethyl)phenyl]-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
2-methyl-N-[4-(2-{[(2-methylphenyl)methyl]amino}-2-oxoethyl)phenyl]-5,6-dihydro-1,4-oxathiine-3-carboxamide
2-methyl-N-[4-(2-{[(2-methylphenyl)methyl]amino}-2-oxoethyl)phenyl]-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E532-2258 |
| Compound Name: | 2-methyl-N-[4-(2-{[(2-methylphenyl)methyl]amino}-2-oxoethyl)phenyl]-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 396.51 |
| Molecular Formula: | C22 H24 N2 O3 S |
| Smiles: | CC1=C(C(Nc2ccc(CC(NCc3ccccc3C)=O)cc2)=O)SCCO1 |
| Stereo: | ACHIRAL |
| logP: | 2.9977 |
| logD: | 2.9952 |
| logSw: | -3.2665 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.8 |
| InChI Key: | INCSXPIBRQNIIY-UHFFFAOYSA-N |