ethyl 2-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]butanamido}-4,5-dimethylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]butanamido}-4,5-dimethylthiophene-3-carboxylate
ethyl 2-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]butanamido}-4,5-dimethylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | D321-0436 |
| Compound Name: | ethyl 2-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]butanamido}-4,5-dimethylthiophene-3-carboxylate |
| Molecular Weight: | 447.94 |
| Molecular Formula: | C21 H22 Cl N3 O4 S |
| Smiles: | CCOC(c1c(C)c(C)sc1NC(CCCc1nc(c2ccc(cc2)[Cl])no1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0497 |
| logD: | 2.6848 |
| logSw: | -5.4479 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.007 |
| InChI Key: | WHIQGFWMSKXWRG-UHFFFAOYSA-N |