2-methyl-N-{2-methyl-5-[(3-methylbutyl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
2-methyl-N-{2-methyl-5-[(3-methylbutyl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-3-carboxamide
2-methyl-N-{2-methyl-5-[(3-methylbutyl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E532-1263 |
| Compound Name: | 2-methyl-N-{2-methyl-5-[(3-methylbutyl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 362.49 |
| Molecular Formula: | C19 H26 N2 O3 S |
| Smiles: | CC(C)CCNC(c1ccc(C)c(c1)NC(C1=C(C)OCCS1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5313 |
| logD: | 2.5195 |
| logSw: | -2.8918 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.429 |
| InChI Key: | VIWIEJGSEVUWLY-UHFFFAOYSA-N |