7-bromo-2-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1-phenyl-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Chemical Structure Depiction of
7-bromo-2-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1-phenyl-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
7-bromo-2-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1-phenyl-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Compound characteristics
| Compound ID: | Y070-5055 |
| Compound Name: | 7-bromo-2-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1-phenyl-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione |
| Molecular Weight: | 496.38 |
| Molecular Formula: | C23 H18 Br N3 O3 S |
| Smiles: | CC(C)Cc1nnc(N2C(C3=C(C2=O)Oc2ccc(cc2C3=O)[Br])c2ccccc2)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5491 |
| logD: | 5.5491 |
| logSw: | -5.5036 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.936 |
| InChI Key: | AISCNTWEPASETC-LJQANCHMSA-N |