TL;DR: 2-Propenamide, 3,3'-(1,4-phenylene)bis[N-(5-chloro-2,4-dimethoxyphenyl)-3-hydroxy-, disodium salt (CAS 68556-15-0) is a chemical compound with molecular formula C28H24Cl2N2Na2O8 and molecular weight 632.0705 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
disodium;3-(5-chloro-2,4-dimethoxyanilino)-1-[4-[3-(5-chloro-2,4-dimethoxyanilino)-1-oxido-3-oxoprop-1-enyl]phenyl]-3-oxoprop-1-en-1-olate
Also Known As: 2-Propenamide, 3,3'-(1,4-phenylene)bis[N-(5-chloro-2,4-dimethoxyphenyl)-3-hydroxy-, disodium salt
| Molecular Formula | C28H24Cl2N2Na2O8 |
| Molecular Weight | 632.0705 g/mol |
| XLogP | -2.28 |
| Topological Polar Surface Area (TPSA) | 141.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 632.0705 Da |
| Heavy Atoms | 42 |
| Complexity | 839.0 |
| SMILES | COC1=CC(=C(C=C1NC(=O)C=C(C2=CC=C(C=C2)C(=CC(=O)NC3=CC(=C(C=C3OC)OC)Cl)[O-])[O-])Cl)OC.[Na+].[Na+] |
| InChIKey | LTFHLPGJJNSFHC-UHFFFAOYSA-L |
The XLogP value of -2.28 indicates that 2-Propenamide, 3,3'-(1,4-phenylene)bis[N-(5-chloro-2,4-dimethoxyphenyl)-3-hydroxy-, disodium salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 141.0 Ų indicates high polarity, suggesting 2-Propenamide, 3,3'-(1,4-phenylene)bis[N-(5-chloro-2,4-dimethoxyphenyl)-3-hydroxy-, disodium salt may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Propenamide, 3,3'-(1,4-phenylene)bis[N-(5-chloro-2,4-dimethoxyphenyl)-3-hydroxy-, disodium salt has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-Propenamide, 3,3'-(1,4-phenylene)bis[N-(5-chloro-2,4-dimethoxyphenyl)-3-hydroxy-, disodium salt is 68556-15-0.
The molecular formula of 2-Propenamide, 3,3'-(1,4-phenylene)bis[N-(5-chloro-2,4-dimethoxyphenyl)-3-hydroxy-, disodium salt is C28H24Cl2N2Na2O8.
The molecular weight of 2-Propenamide, 3,3'-(1,4-phenylene)bis[N-(5-chloro-2,4-dimethoxyphenyl)-3-hydroxy-, disodium salt is 632.0705 g/mol.
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