2-[3-(1H-imidazol-1-yl)propyl]-7-methyl-1-(4-methylphenyl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Chemical Structure Depiction of
2-[3-(1H-imidazol-1-yl)propyl]-7-methyl-1-(4-methylphenyl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
2-[3-(1H-imidazol-1-yl)propyl]-7-methyl-1-(4-methylphenyl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Compound characteristics
| Compound ID: | D417-0138 |
| Compound Name: | 2-[3-(1H-imidazol-1-yl)propyl]-7-methyl-1-(4-methylphenyl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione |
| Molecular Weight: | 413.48 |
| Molecular Formula: | C25 H23 N3 O3 |
| Smiles: | Cc1ccc(cc1)C1C2=C(C(N1CCCn1ccnc1)=O)Oc1ccc(C)cc1C2=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5395 |
| logD: | 3.2976 |
| logSw: | -3.5909 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.512 |
| InChI Key: | MXQIPKVGFVROBI-JOCHJYFZSA-N |