TL;DR: Diethyl [([1,1'-biphenyl]-2-yl)methyl](formamido)propanedioate (CAS 151888-33-4) is a chemical compound with molecular formula C21H23NO5 and molecular weight 369.15762 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diethyl 2-formamido-2-[(2-phenylphenyl)methyl]propanedioate
Also Known As: Diethyl 2-formamido-2-[(2-phenylphenyl)methyl]propanedioate, Diethyl [([1,1'-biphenyl]-2-yl)methyl](formamido)propanedioate, 1,3-Diethyl 2-([1,1'-biphenyl]-2-ylmethyl)-2-(formylamino)propanedioate, 1,3-Diethyl 2-([1,1a(2)-biphenyl]-2-ylmethyl)-2-(formylamino)propanedioate
| Molecular Formula | C21H23NO5 |
| Molecular Weight | 369.15762 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 369.15762 Da |
| Heavy Atoms | 27 |
| Complexity | 483.0 |
| SMILES | CCOC(=O)C(CC1=CC=CC=C1C2=CC=CC=C2)(C(=O)OCC)NC=O |
| InChIKey | SBBFFUVVRUFEGG-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that Diethyl [([1,1'-biphenyl]-2-yl)methyl](formamido)propanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl [([1,1'-biphenyl]-2-yl)methyl](formamido)propanedioate. Following Lipinski's Rule of Five, Diethyl [([1,1'-biphenyl]-2-yl)methyl](formamido)propanedioate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Diethyl [([1,1'-biphenyl]-2-yl)methyl](formamido)propanedioate is 151888-33-4.
The molecular formula of Diethyl [([1,1'-biphenyl]-2-yl)methyl](formamido)propanedioate is C21H23NO5.
The molecular weight of Diethyl [([1,1'-biphenyl]-2-yl)methyl](formamido)propanedioate is 369.15762 g/mol.
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