TL;DR: Diphenylpropanedioic acid (CAS 103053-17-4) is a chemical compound with molecular formula C15H12O4 and molecular weight 256.07355 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2-diphenylpropanedioic acid
Also Known As: diphenylpropanedioic acid, Diphenylmalonsaure, diphenylmalonic acid, 2,2-diphenylpropanedioicacid, 2,2-diphenylpropanedioic acid
Top 5 of 13 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C15H12O4 |
| Molecular Weight | 256.07355 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 256.07355 Da |
| Heavy Atoms | 19 |
| Complexity | 304.0 |
| SMILES | C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)O)C(=O)O |
| InChIKey | YJGUVTBNQCVSQB-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diphenylpropanedioic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Diphenylpropanedioic acid. Following Lipinski's Rule of Five, Diphenylpropanedioic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Diphenylpropanedioic acid is 103053-17-4.
The molecular formula of Diphenylpropanedioic acid is C15H12O4.
The molecular weight of Diphenylpropanedioic acid is 256.07355 g/mol.
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