1-[3-ethoxy-4-(3-methylbutoxy)phenyl]-2-(1,3,4-thiadiazol-2-yl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Chemical Structure Depiction of
1-[3-ethoxy-4-(3-methylbutoxy)phenyl]-2-(1,3,4-thiadiazol-2-yl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
1-[3-ethoxy-4-(3-methylbutoxy)phenyl]-2-(1,3,4-thiadiazol-2-yl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Compound characteristics
| Compound ID: | 6872-2680 |
| Compound Name: | 1-[3-ethoxy-4-(3-methylbutoxy)phenyl]-2-(1,3,4-thiadiazol-2-yl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione |
| Molecular Weight: | 491.57 |
| Molecular Formula: | C26 H25 N3 O5 S |
| Smiles: | CCOc1cc(ccc1OCCC(C)C)C1C2=C(C(N1c1nncs1)=O)Oc1ccccc1C2=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5289 |
| logD: | 4.5289 |
| logSw: | -4.3346 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.186 |
| InChI Key: | AWODZXOSPZFHCJ-JOCHJYFZSA-N |