6-{5-[1-(4-chlorobenzene-1-sulfonyl)piperidin-4-yl]-1,2,4-oxadiazol-3-yl}-3-ethyl-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-{5-[1-(4-chlorobenzene-1-sulfonyl)piperidin-4-yl]-1,2,4-oxadiazol-3-yl}-3-ethyl-1,3-benzoxazol-2(3H)-one
6-{5-[1-(4-chlorobenzene-1-sulfonyl)piperidin-4-yl]-1,2,4-oxadiazol-3-yl}-3-ethyl-1,3-benzoxazol-2(3H)-one
Compound characteristics
Compound ID: | M355-0252 |
Compound Name: | 6-{5-[1-(4-chlorobenzene-1-sulfonyl)piperidin-4-yl]-1,2,4-oxadiazol-3-yl}-3-ethyl-1,3-benzoxazol-2(3H)-one |
Molecular Weight: | 488.95 |
Molecular Formula: | C22 H21 Cl N4 O5 S |
Smiles: | CCN1C(=O)Oc2cc(ccc12)c1nc(C2CCN(CC2)S(c2ccc(cc2)[Cl])(=O)=O)on1 |
Stereo: | ACHIRAL |
logP: | 4.8976 |
logD: | 4.8976 |
logSw: | -5.0479 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 86.18 |
InChI Key: | KQGWQVQBASGTSC-UHFFFAOYSA-N |