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Diethyl [anilino(phenyl)methyl]malonate
TL;DR: Diethyl [anilino(phenyl)methyl]malonate (CAS 58929-06-9) is a chemical compound with molecular formula C20H23NO4 and molecular weight 341.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[anilino(phenyl)methyl]propanedioate
Also Known As: diethyl [anilino(phenyl)methyl]malonate, diethyl 2-[anilino(phenyl)methyl]malonate, diethyl 2-[anilino(phenyl)methyl]propanedioate, diethyl 2-(phenyl(phenylamino)methyl)malonate, J2.283.515G
| Molecular Formula | C20H23NO4 |
|---|---|
| Molecular Weight | 341.16 g/mol |
| LogP | 3.5822 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 341.16272 |
| Heavy Atoms | 25 |
| Complexity | 654.6102 |
Chemical Identifiers
| CAS Number | 58929-06-9 |
|---|---|
| SMILES | CCOC(=O)C(C(C1=CC=CC=C1)NC2=CC=CC=C2)C(=O)OCC |
Product Overview
Diethyl [anilino(phenyl)methyl]malonate (CAS 58929-06-9), with molecular formula C20H23NO4 and molecular weight 341.16 g/mol. IUPAC: diethyl 2-[anilino(phenyl)methyl]propanedioate.
Chemical Property Profile of Diethyl [anilino(phenyl)methyl]malonate
Property Insights of Diethyl [anilino(phenyl)methyl]malonate
The XLogP value of 3.5822 indicates that Diethyl [anilino(phenyl)methyl]malonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl [anilino(phenyl)methyl]malonate. Following Lipinski's Rule of Five, Diethyl [anilino(phenyl)methyl]malonate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Diethyl [anilino(phenyl)methyl]malonate?
The CAS number of Diethyl [anilino(phenyl)methyl]malonate is 58929-06-9.
What is the molecular formula of Diethyl [anilino(phenyl)methyl]malonate?
The molecular formula of Diethyl [anilino(phenyl)methyl]malonate is C20H23NO4.
What is the molecular weight of Diethyl [anilino(phenyl)methyl]malonate?
The molecular weight of Diethyl [anilino(phenyl)methyl]malonate is 341.16 g/mol.
Where can I buy Diethyl [anilino(phenyl)methyl]malonate?
You can request a quote for Diethyl [anilino(phenyl)methyl]malonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl [anilino(phenyl)methyl]malonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl [anilino(phenyl)methyl]malonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.