N-(5-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]carbamoyl}-2-methylphenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-(5-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]carbamoyl}-2-methylphenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-(5-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]carbamoyl}-2-methylphenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-1559 |
| Compound Name: | N-(5-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]carbamoyl}-2-methylphenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 401.48 |
| Molecular Formula: | C20 H23 N3 O4 S |
| Smiles: | Cc1ccc(cc1NC(C1=CSCCO1)=O)C(NCCc1c(C)noc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8102 |
| logD: | 1.805 |
| logSw: | -2.5693 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.554 |
| InChI Key: | LBBBDPMALYULIJ-UHFFFAOYSA-N |