N-(4-{[2-(4-ethoxyphenyl)ethyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-(4-{[2-(4-ethoxyphenyl)ethyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-(4-{[2-(4-ethoxyphenyl)ethyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-0294 |
| Compound Name: | N-(4-{[2-(4-ethoxyphenyl)ethyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 412.51 |
| Molecular Formula: | C22 H24 N2 O4 S |
| Smiles: | CCOc1ccc(CCNC(c2ccc(cc2)NC(C2=CSCCO2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.667 |
| logD: | 2.5031 |
| logSw: | -3.1373 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.337 |
| InChI Key: | MSLOLUPDRVUEOH-UHFFFAOYSA-N |