1-(3,4-dimethoxyphenyl)-7-fluoro-2-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Chemical Structure Depiction of
1-(3,4-dimethoxyphenyl)-7-fluoro-2-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
1-(3,4-dimethoxyphenyl)-7-fluoro-2-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Compound characteristics
| Compound ID: | Y070-4916 |
| Compound Name: | 1-(3,4-dimethoxyphenyl)-7-fluoro-2-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione |
| Molecular Weight: | 495.53 |
| Molecular Formula: | C25 H22 F N3 O5 S |
| Smiles: | CC(C)Cc1nnc(N2C(C3=C(C2=O)Oc2ccc(cc2C3=O)F)c2ccc(c(c2)OC)OC)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5555 |
| logD: | 4.5554 |
| logSw: | -4.5208 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.197 |
| InChI Key: | LUVUECWRLKBBPH-OAQYLSRUSA-N |