AC1LYP3X
2-[4-[(E)-(1-cyclohexyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetic acid
Also Known As: 2-[4-[(1-cyclohexyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetic Acid|2-[4-[(E)-(1-cyclohexyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetic acid|(E)-2-(4-((1-cyclohexyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)phenoxy)acetic acid|{4-[(E)-(1-cyclohexyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]phenoxy}acetic acid
| Molecular Formula | C19H20N2O6 |
|---|---|
| Molecular Weight | 372.13214 g/mol |
| LogP | 1.9445 |
| Topological Polar Surface Area | 113.01 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 372.13214 |
| Monoisotopic Mass | 372.13214 |
| Heavy Atoms | 27 |
| Complexity | 792.92285 |
Chemical Identifiers
| CAS Number | 373375-31-6 |
|---|---|
| SMILES | C1CCC(CC1)N2C(=O)/C(=C/C3=CC=C(C=C3)OCC(=O)O)/C(=O)NC2=O |
Product Overview
AC1LYP3X (CAS 373375-31-6), with molecular formula C19H20N2O6 and molecular weight 372.13214 g/mol. IUPAC: 2-[4-[(E)-(1-cyclohexyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetic acid.
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