4-[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl]-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl]-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
4-[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl]-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
Compound ID: | L309-1255 |
Compound Name: | 4-[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl]-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one |
Molecular Weight: | 418.47 |
Molecular Formula: | C19 H22 N4 O5 S |
Smiles: | C1CC(C1)c1nc(CN2C(COc3ccc(cc23)S(N2CCCC2)(=O)=O)=O)no1 |
Stereo: | ACHIRAL |
logP: | 1.9873 |
logD: | 1.9873 |
logSw: | -2.7625 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 89.336 |
InChI Key: | VGHWHUSAFZNFIL-UHFFFAOYSA-N |