2-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1-{3-[(prop-2-en-1-yl)oxy]phenyl}-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Chemical Structure Depiction of
2-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1-{3-[(prop-2-en-1-yl)oxy]phenyl}-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
2-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1-{3-[(prop-2-en-1-yl)oxy]phenyl}-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Compound characteristics
| Compound ID: | 6391-0458 |
| Compound Name: | 2-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1-{3-[(prop-2-en-1-yl)oxy]phenyl}-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione |
| Molecular Weight: | 459.52 |
| Molecular Formula: | C25 H21 N3 O4 S |
| Smiles: | CC(C)c1nnc(N2C(C3=C(C2=O)Oc2ccccc2C3=O)c2cccc(c2)OCC=C)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7748 |
| logD: | 4.7747 |
| logSw: | -4.6547 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.858 |
| InChI Key: | VWZKOKGVDLBHQC-HXUWFJFHSA-N |