N-{5-[(butan-2-yl)carbamoyl]-2-methylphenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-{5-[(butan-2-yl)carbamoyl]-2-methylphenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-{5-[(butan-2-yl)carbamoyl]-2-methylphenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-1416 |
| Compound Name: | N-{5-[(butan-2-yl)carbamoyl]-2-methylphenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 334.44 |
| Molecular Formula: | C17 H22 N2 O3 S |
| Smiles: | CCC(C)NC(c1ccc(C)c(c1)NC(C1=CSCCO1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9246 |
| logD: | 1.9194 |
| logSw: | -2.6417 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.387 |
| InChI Key: | FDMKXFNDCSVCDH-LBPRGKRZSA-N |