AC1ME4TD
5-[[3-carboxy-4-[[2-(3,4-dimethoxyphenyl)acetyl]amino]phenyl]methyl]-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]benzoic acid
Also Known As: Oprea1_444164|3,3'-methanediylbis(6-{[(3,4-dimethoxyphenyl)acetyl]amino}benzoic acid)|3,3'-methylenebis(6-{[(3,4-dimethoxyphenyl)acetyl]amino}benzoic acid)|3,3'-Methylenebis{6-[2-(3,4-dimethoxyphenyl)acetamido]benzoic acid}|5-[[3-carboxy-4-[[2-(3,4-dimethoxyphenyl)acetyl]amino]phenyl]methyl]-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]benzoic acid|5-({3-CARBOXY-4-[2-(3,4-DIMETHOXYPHENYL)ACETAMIDO]PHENYL}METHYL)-2-[2-(3,4-DIMETHOXYPHENYL)ACETAMIDO]BENZOIC ACID
| Molecular Formula | C35H34N2O10 |
|---|---|
| Molecular Weight | 642.2214 g/mol |
| LogP | 5.0706 |
| Topological Polar Surface Area | 169.72 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 14 |
| Exact Mass | 642.2214 |
| Monoisotopic Mass | 642.2214 |
| Heavy Atoms | 47 |
| Complexity | 1687.5422 |
Chemical Identifiers
| CAS Number | 5477-47-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CC(=O)NC2=C(C=C(C=C2)CC3=CC(=C(C=C3)NC(=O)CC4=CC(=C(C=C4)OC)OC)C(=O)O)C(=O)O)OC |
Product Overview
AC1ME4TD (CAS 5477-47-4), with molecular formula C35H34N2O10 and molecular weight 642.2214 g/mol. IUPAC: 5-[[3-carboxy-4-[[2-(3,4-dimethoxyphenyl)acetyl]amino]phenyl]methyl]-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]benzoic acid.
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