1-{4-chloro-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzene-1-sulfonyl}piperidine-4-carboxylic acid
Chemical Structure Depiction of
1-{4-chloro-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzene-1-sulfonyl}piperidine-4-carboxylic acid
1-{4-chloro-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzene-1-sulfonyl}piperidine-4-carboxylic acid
Compound characteristics
| Compound ID: | J057-1481 |
| Compound Name: | 1-{4-chloro-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzene-1-sulfonyl}piperidine-4-carboxylic acid |
| Molecular Weight: | 477.92 |
| Molecular Formula: | C21 H20 Cl N3 O6 S |
| Smiles: | COc1ccc(cc1)c1nnc(c2cc(ccc2[Cl])S(N2CCC(CC2)C(O)=O)(=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.7875 |
| logD: | 0.2272 |
| logSw: | -3.4909 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.145 |
| InChI Key: | RUIHPJQFBSNFMO-UHFFFAOYSA-N |