7-[3-(2-amino-2-oxoethoxy)phenyl]-3-(4-chlorophenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
Chemical Structure Depiction of
7-[3-(2-amino-2-oxoethoxy)phenyl]-3-(4-chlorophenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
7-[3-(2-amino-2-oxoethoxy)phenyl]-3-(4-chlorophenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
Compound characteristics
| Compound ID: | D562-0213 |
| Compound Name: | 7-[3-(2-amino-2-oxoethoxy)phenyl]-3-(4-chlorophenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid |
| Molecular Weight: | 456.9 |
| Molecular Formula: | C22 H17 Cl N2 O5 S |
| Smiles: | C1C(c2cccc(c2)OCC(N)=O)c2c(c(c3ccc(cc3)[Cl])c(C(O)=O)s2)NC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6761 |
| logD: | 0.876 |
| logSw: | -3.5606 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 92.578 |
| InChI Key: | MXKWEERAPHPXIP-HNNXBMFYSA-N |