Diethyl benzamido(methyl)propanedioate
TL;DR: Diethyl benzamido(methyl)propanedioate (CAS 81917-90-0) is a chemical compound with molecular formula C15H19NO5 and molecular weight 293.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-benzamido-2-methylpropanedioate
Also Known As: diethyl 2-benzamido-2-methylpropanedioate, Diethyl benzamido(methyl)propanedioate
| Molecular Formula | C15H19NO5 |
|---|---|
| Molecular Weight | 293.13 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 293.1263 |
| Heavy Atoms | 21 |
| Complexity | 370.0 |
Chemical Identifiers
| CAS Number | 81917-90-0 |
|---|---|
| SMILES | CCOC(=O)C(C)(C(=O)OCC)NC(=O)C1=CC=CC=C1 |
| InChIKey | KZEOGCIMJSXSOF-UHFFFAOYSA-N |
Product Overview
Diethyl benzamido(methyl)propanedioate (CAS 81917-90-0), with molecular formula C15H19NO5 and molecular weight 293.13 g/mol. IUPAC: diethyl 2-benzamido-2-methylpropanedioate.
Chemical Property Profile of Diethyl benzamido(methyl)propanedioate
Property Insights of Diethyl benzamido(methyl)propanedioate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl benzamido(methyl)propanedioate. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl benzamido(methyl)propanedioate. Following Lipinski's Rule of Five, Diethyl benzamido(methyl)propanedioate 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 benzamido(methyl)propanedioate?
The CAS number of Diethyl benzamido(methyl)propanedioate is 81917-90-0.
What is the molecular formula of Diethyl benzamido(methyl)propanedioate?
The molecular formula of Diethyl benzamido(methyl)propanedioate is C15H19NO5.
What is the molecular weight of Diethyl benzamido(methyl)propanedioate?
The molecular weight of Diethyl benzamido(methyl)propanedioate is 293.13 g/mol.
Where can I buy Diethyl benzamido(methyl)propanedioate?
You can request a quote for Diethyl benzamido(methyl)propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl benzamido(methyl)propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl benzamido(methyl)propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.