1-(4-methylphenyl)-2-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Chemical Structure Depiction of
1-(4-methylphenyl)-2-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
1-(4-methylphenyl)-2-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Compound characteristics
| Compound ID: | 6391-0416 |
| Compound Name: | 1-(4-methylphenyl)-2-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione |
| Molecular Weight: | 417.49 |
| Molecular Formula: | C23 H19 N3 O3 S |
| Smiles: | CC(C)c1nnc(N2C(C3=C(C2=O)Oc2ccccc2C3=O)c2ccc(C)cc2)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6263 |
| logD: | 4.6262 |
| logSw: | -4.63 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.44 |
| InChI Key: | MHGSMQFZJPEHRF-GOSISDBHSA-N |