N-[5-(cyclooctylcarbamoyl)-2-methylphenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-[5-(cyclooctylcarbamoyl)-2-methylphenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-[5-(cyclooctylcarbamoyl)-2-methylphenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-1428 |
| Compound Name: | N-[5-(cyclooctylcarbamoyl)-2-methylphenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 388.53 |
| Molecular Formula: | C21 H28 N2 O3 S |
| Smiles: | Cc1ccc(cc1NC(C1=CSCCO1)=O)C(NC1CCCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9694 |
| logD: | 3.9641 |
| logSw: | -4.0006 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.73 |
| InChI Key: | WYNINZYLWANSKZ-UHFFFAOYSA-N |