2-[(2H-1,3-benzodioxol-5-yl)methyl]-8-(4-bromophenyl)-1,3,4-trimethyl-2H-dipyrrolo[1,2-b:3',4'-d]pyridazine
Chemical Structure Depiction of
2-[(2H-1,3-benzodioxol-5-yl)methyl]-8-(4-bromophenyl)-1,3,4-trimethyl-2H-dipyrrolo[1,2-b:3',4'-d]pyridazine
2-[(2H-1,3-benzodioxol-5-yl)methyl]-8-(4-bromophenyl)-1,3,4-trimethyl-2H-dipyrrolo[1,2-b:3',4'-d]pyridazine
Compound characteristics
| Compound ID: | D132-0038 |
| Compound Name: | 2-[(2H-1,3-benzodioxol-5-yl)methyl]-8-(4-bromophenyl)-1,3,4-trimethyl-2H-dipyrrolo[1,2-b:3',4'-d]pyridazine |
| Molecular Weight: | 488.38 |
| Molecular Formula: | C26 H22 Br N3 O2 |
| Smiles: | Cc1c2c(c(C)n(Cc3ccc4c(c3)OCO4)c2C)c2cc(cn2n1)c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.2516 |
| logD: | 6.1442 |
| logSw: | -5.9114 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 29.8524 |
| InChI Key: | ODYVMKUANQIKDR-UHFFFAOYSA-N |