6-{5-[1-(4-methylbenzene-1-sulfonyl)piperidin-3-yl]-1,2,4-oxadiazol-3-yl}-4-propyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-{5-[1-(4-methylbenzene-1-sulfonyl)piperidin-3-yl]-1,2,4-oxadiazol-3-yl}-4-propyl-2H-1,4-benzoxazin-3(4H)-one
6-{5-[1-(4-methylbenzene-1-sulfonyl)piperidin-3-yl]-1,2,4-oxadiazol-3-yl}-4-propyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | L834-1030 |
| Compound Name: | 6-{5-[1-(4-methylbenzene-1-sulfonyl)piperidin-3-yl]-1,2,4-oxadiazol-3-yl}-4-propyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 496.58 |
| Molecular Formula: | C25 H28 N4 O5 S |
| Smiles: | CCCN1C(COc2ccc(cc12)c1nc(C2CCCN(C2)S(c2ccc(C)cc2)(=O)=O)on1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4558 |
| logD: | 4.4558 |
| logSw: | -4.3589 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.368 |
| InChI Key: | ZOAFBNAXRQBVIB-IBGZPJMESA-N |