1-[4-chloro-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzene-1-sulfonyl]piperidine-4-carboxylic acid
Chemical Structure Depiction of
1-[4-chloro-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzene-1-sulfonyl]piperidine-4-carboxylic acid
1-[4-chloro-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzene-1-sulfonyl]piperidine-4-carboxylic acid
Compound characteristics
Compound ID: | J057-1072 |
Compound Name: | 1-[4-chloro-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzene-1-sulfonyl]piperidine-4-carboxylic acid |
Molecular Weight: | 447.9 |
Molecular Formula: | C20 H18 Cl N3 O5 S |
Smiles: | C1CN(CCC1C(O)=O)S(c1ccc(c(c1)c1nnc(c2ccccc2)o1)[Cl])(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.7001 |
logD: | 0.1397 |
logSw: | -3.6221 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 90.602 |
InChI Key: | YBGOWZXVPQMQDJ-UHFFFAOYSA-N |