AC1MDXBS
5-(3-bromo-4-hydroxy-5-methoxyphenyl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one
Also Known As: ChemDiv1_019828|Oprea1_710852|Oprea1_760382|HMS643F06|BAS 00457655|AE-641/09779060|A1812/0076621|5-(3-bromo-4-hydroxy-5-methoxyphenyl)-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one|2-bromo-4-(2,2-dimethyl-4-oxo-1,3,5,6-tetrahydrobenzo[a]phenanthridin-6-ium-5-yl)-6-methoxyphenolate|5-(3-bromo-4-hydroxy-5-methoxyphenyl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one|5-(3-BROMO-4-HYDROXY-5-METHOXYPHENYL)-2,2-DIMETHYL-1H,2H,3H,4H,5H,6H-BENZO[A]PHENANTHRIDIN-4-ONE
| Molecular Formula | C26H24BrNO3 |
|---|---|
| Molecular Weight | 477.09396 g/mol |
| LogP | 6.626 |
| Topological Polar Surface Area | 58.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 477.09396 |
| Monoisotopic Mass | 477.09396 |
| Heavy Atoms | 31 |
| Complexity | 1275.1273 |
Chemical Identifiers
| CAS Number | 296791-76-9 |
|---|---|
| SMILES | CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC(=C(C(=C5)Br)O)OC)C(=O)C1)C |
Product Overview
AC1MDXBS (CAS 296791-76-9), with molecular formula C26H24BrNO3 and molecular weight 477.09396 g/mol. IUPAC: 5-(3-bromo-4-hydroxy-5-methoxyphenyl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one.
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