Methyl 3,4-diacetamidobenzoate
TL;DR: Methyl 3,4-diacetamidobenzoate (CAS 175204-18-9) is a chemical compound with molecular formula C12H14N2O4 and molecular weight 250.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3,4-diacetamidobenzoate
Also Known As: methyl 3,4-diacetamidobenzoate, methyl 3,4-di(acetylamino)benzoate, Maybridge1_005993, 3,5,6-Trifluoro-2-hydroxypyridine, METHYL3,4-DI(ACETYLAMINO)BENZOATE
| Molecular Formula | C12H14N2O4 |
|---|---|
| Molecular Weight | 250.10 g/mol |
| LogP | 1.39 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.09535 |
| Heavy Atoms | 18 |
| Complexity | 496.85083 |
Chemical Identifiers
| CAS Number | 175204-18-9 |
|---|---|
| SMILES | CC(=O)NC1=C(C=C(C=C1)C(=O)OC)NC(=O)C |
Product Overview
Methyl 3,4-diacetamidobenzoate (CAS 175204-18-9), with molecular formula C12H14N2O4 and molecular weight 250.10 g/mol. IUPAC: methyl 3,4-diacetamidobenzoate.
Chemical Property Profile of Methyl 3,4-diacetamidobenzoate
Property Insights of Methyl 3,4-diacetamidobenzoate
The XLogP value of 1.39 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3,4-diacetamidobenzoate. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3,4-diacetamidobenzoate. Following Lipinski's Rule of Five, Methyl 3,4-diacetamidobenzoate has 2 hydrogen bond donor(s) and 4 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 Methyl 3,4-diacetamidobenzoate?
The CAS number of Methyl 3,4-diacetamidobenzoate is 175204-18-9.
What is the molecular formula of Methyl 3,4-diacetamidobenzoate?
The molecular formula of Methyl 3,4-diacetamidobenzoate is C12H14N2O4.
What is the molecular weight of Methyl 3,4-diacetamidobenzoate?
The molecular weight of Methyl 3,4-diacetamidobenzoate is 250.10 g/mol.
Where can I buy Methyl 3,4-diacetamidobenzoate?
You can request a quote for Methyl 3,4-diacetamidobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3,4-diacetamidobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3,4-diacetamidobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.