AC1M3O1I
2-[2-bromo-6-methoxy-4-[(Z)-[1-(3-methylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetic acid
Also Known As: (2-bromo-6-methoxy-4-{(Z)-[1-(3-methylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenoxy)acetic acid|(Z)-2-(2-bromo-6-methoxy-4-((2,4,6-trioxo-1-(m-tolyl)tetrahydropyrimidin-5(2H)-ylidene)methyl)phenoxy)acetic acid|2-[2-bromo-6-methoxy-4-[(Z)-[1-(3-methylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetic acid
| Molecular Formula | C21H17BrN2O7 |
|---|---|
| Molecular Weight | 488.0219 g/mol |
| LogP | 2.89592 |
| Topological Polar Surface Area | 122.24 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 488.0219 |
| Monoisotopic Mass | 488.0219 |
| Heavy Atoms | 31 |
| Complexity | 1126.7065 |
Chemical Identifiers
| CAS Number | 347394-39-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=O)/C(=C\C3=CC(=C(C(=C3)Br)OCC(=O)O)OC)/C(=O)NC2=O |
Product Overview
AC1M3O1I (CAS 347394-39-2), with molecular formula C21H17BrN2O7 and molecular weight 488.0219 g/mol. IUPAC: 2-[2-bromo-6-methoxy-4-[(Z)-[1-(3-methylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetic acid.
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