{2-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-5-methyl-1,3-oxazol-4-yl}(thiomorpholin-4-yl)methanone
Chemical Structure Depiction of
{2-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-5-methyl-1,3-oxazol-4-yl}(thiomorpholin-4-yl)methanone
{2-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-5-methyl-1,3-oxazol-4-yl}(thiomorpholin-4-yl)methanone
Compound characteristics
| Compound ID: | P435-0768 |
| Compound Name: | {2-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-5-methyl-1,3-oxazol-4-yl}(thiomorpholin-4-yl)methanone |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C22 H25 N3 O5 S |
| Smiles: | Cc1c(C(N2CCSCC2)=O)nc(C2CCN(CC2)C(c2ccc3c(c2)OCO3)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.0637 |
| logD: | 2.0637 |
| logSw: | -2.7356 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.277 |
| InChI Key: | TYWHIGPTWPCYOF-UHFFFAOYSA-N |