N-{2-methyl-5-[(3-methylbutyl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-{2-methyl-5-[(3-methylbutyl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-{2-methyl-5-[(3-methylbutyl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-1474 |
| Compound Name: | N-{2-methyl-5-[(3-methylbutyl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 348.46 |
| Molecular Formula: | C18 H24 N2 O3 S |
| Smiles: | CC(C)CCNC(c1ccc(C)c(c1)NC(C1=CSCCO1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6713 |
| logD: | 2.6661 |
| logSw: | -3.0597 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.787 |
| InChI Key: | DFKISLALUFXKGX-UHFFFAOYSA-N |