AC1NV4KA
2-bromo-4-[[2-(3-bromo-4-hydroxy-5-methoxyphenyl)benzimidazol-1-yl]methyl]-6-methoxyphenol
Also Known As: Oprea1_372638|2-bromo-4-(1-(3-bromo-4-hydroxy-5-methoxybenzyl)-1H-benzo[d]imidazol-2-yl)-6-methoxyphenol|2-bromo-4-[1-(3-bromo-4-hydroxy-5-methoxybenzyl)-1H-benzimidazol-2-yl]-6-methoxyphenol|(4Z)-2-bromo-4-[3-[(3-bromo-4-hydroxy-5-methoxyphenyl)methyl]-1H-benzimidazol-2-ylidene]-6-methoxycyclohexa-2,5-dien-1-one|2-bromo-4-[1-(3-bromo-4-hydroxy-5-methoxybenzyl)-1H-3,1-benzimidazol-3-ium-2-yl]-6-methoxyphenolate|2-bromo-4-[3-[(3-bromo-4-hydroxy-5-methoxyphenyl)methyl]-1H-benzimidazol-2-ylidene]-6-methoxycyclohexa-2,5-dien-1-one|2-bromo-4-{1-[(3-bromo-4-hydroxy-5-methoxyphenyl)methyl]benzimidazol-2-yl}-6-m ethoxyphenol
| Molecular Formula | C22H18Br2N2O4 |
|---|---|
| Molecular Weight | 531.9633 g/mol |
| LogP | 5.705 |
| Topological Polar Surface Area | 76.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 531.9633 |
| Monoisotopic Mass | 533.9613 |
| Heavy Atoms | 30 |
| Complexity | 1253.8456 |
Chemical Identifiers
| CAS Number | 537010-63-2 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)CN2C3=CC=CC=C3N=C2C4=CC(=C(C(=C4)Br)O)OC)Br)O |
Product Overview
AC1NV4KA (CAS 537010-63-2), with molecular formula C22H18Br2N2O4 and molecular weight 531.9633 g/mol. IUPAC: 2-bromo-4-[[2-(3-bromo-4-hydroxy-5-methoxyphenyl)benzimidazol-1-yl]methyl]-6-methoxyphenol.