![1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate structure](/static/products/4254/425413-53-2.webp)
1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate
TL;DR: 1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate (CAS 425413-53-2) is a chemical compound with molecular formula C21H23NO7 and molecular weight 401.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 5-[(3,5-diethoxybenzoyl)amino]benzene-1,3-dicarboxylate
Also Known As: BIM-0010738.P001, AB00103186-01, 1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate, Dimethyl 5-(3,5-diethoxybenzamido)benzene-1,3-dicarboxylate, dimethyl 5-[(3,5-diethoxybenzoyl)amino]benzene-1,3-dicarboxylate
| Molecular Formula | C21H23NO7 |
|---|---|
| Molecular Weight | 401.15 g/mol |
| LogP | 3.3095 |
| Topological Polar Surface Area | 100.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 401.14746 |
| Heavy Atoms | 29 |
| Complexity | 849.39777 |
Chemical Identifiers
| CAS Number | 425413-53-2 |
|---|---|
| SMILES | CCOC1=CC(=CC(=C1)C(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)OCC |
Product Overview
1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate (CAS 425413-53-2), with molecular formula C21H23NO7 and molecular weight 401.15 g/mol. IUPAC: dimethyl 5-[(3,5-diethoxybenzoyl)amino]benzene-1,3-dicarboxylate.
Chemical Property Profile of 1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate
Property Insights of 1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate
The XLogP value of 3.3095 indicates that 1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate. Following Lipinski's Rule of Five, 1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate has 1 hydrogen bond donor(s) and 7 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 1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate?
The CAS number of 1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate is 425413-53-2.
What is the molecular formula of 1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate?
The molecular formula of 1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate is C21H23NO7.
What is the molecular weight of 1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate?
The molecular weight of 1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate is 401.15 g/mol.
Where can I buy 1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate?
You can request a quote for 1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dimethyl 5-[(3,5-diethoxybenzoyl)amino]-1,3-benzenedicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.