AC1MMLWS
2-amino-4-[3-[(3-bromophenoxy)methyl]-4-methoxyphenyl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile
Also Known As: 2-amino-4-{3-[(3-bromophenoxy)methyl]-4-methoxyphenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile|AK-968/41024570|2-amino-4-[3-[(3-bromophenoxy)methyl]-4-methoxyphenyl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile|2-AMINO-4-{3-[(3-BROMOPHENOXY)METHYL]-4-METHOXYPHENYL}-5-OXO-5,6,7,8-TETRAHYDRO-4H-CHROMEN-3-YL CYANIDE
| Molecular Formula | C24H21BrN2O4 |
|---|---|
| Molecular Weight | 480.06848 g/mol |
| LogP | 4.85148 |
| Topological Polar Surface Area | 94.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 480.06848 |
| Monoisotopic Mass | 480.06848 |
| Heavy Atoms | 31 |
| Complexity | 1146.5085 |
Chemical Identifiers
| CAS Number | 445237-40-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)COC4=CC(=CC=C4)Br |
Product Overview
AC1MMLWS (CAS 445237-40-1), with molecular formula C24H21BrN2O4 and molecular weight 480.06848 g/mol. IUPAC: 2-amino-4-[3-[(3-bromophenoxy)methyl]-4-methoxyphenyl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile.
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