1-(4-tert-butylphenyl)-7-chloro-2-[3-(dimethylamino)propyl]-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Chemical Structure Depiction of
1-(4-tert-butylphenyl)-7-chloro-2-[3-(dimethylamino)propyl]-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
1-(4-tert-butylphenyl)-7-chloro-2-[3-(dimethylamino)propyl]-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Compound characteristics
| Compound ID: | D658-0143 |
| Compound Name: | 1-(4-tert-butylphenyl)-7-chloro-2-[3-(dimethylamino)propyl]-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione |
| Molecular Weight: | 452.98 |
| Molecular Formula: | C26 H29 Cl N2 O3 |
| Smiles: | [H]C([H])(CCN(C)C)N1C(C2=C(C1=O)Oc1ccc(cc1C2=O)[Cl])c1ccc(cc1)C(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2795 |
| logD: | 3.3307 |
| logSw: | -5.8001 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.849 |
| InChI Key: | YBTYKVSPERYRQV-JOCHJYFZSA-N |