AC1NWMLL
2-[4-[(Z)-[1-(3-chlorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-2-ethoxyphenoxy]propanoic acid
Also Known As: 2-(4-{(Z)-[1-(3-chlorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-ethoxyphenoxy)propanoic acid|(Z)-2-(4-((1-(3-chlorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-2-ethoxyphenoxy)propanoic acid|2-[4-[(Z)-[1-(3-chlorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-2-ethoxyphenoxy]propanoic acid
| Molecular Formula | C22H19ClN2O6S |
|---|---|
| Molecular Weight | 474.06525 g/mol |
| LogP | 3.4219 |
| Topological Polar Surface Area | 105.17 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 474.06525 |
| Monoisotopic Mass | 474.06525 |
| Heavy Atoms | 32 |
| Complexity | 1133.1542 |
Chemical Identifiers
| CAS Number | 767293-71-0 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)/C=C\2/C(=O)NC(=S)N(C2=O)C3=CC(=CC=C3)Cl)OC(C)C(=O)O |
Product Overview
AC1NWMLL (CAS 767293-71-0), with molecular formula C22H19ClN2O6S and molecular weight 474.06525 g/mol. IUPAC: 2-[4-[(Z)-[1-(3-chlorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-2-ethoxyphenoxy]propanoic acid.
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