Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate
TL;DR: Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate (CAS 69836-66-4) is a chemical compound with molecular formula C18H17NO6 and molecular weight 343.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 3-(4-acetamidophenyl)-6-hydroxybenzene-1,2-dicarboxylate
Also Known As: dimethyl 3-(p-acetamidophenyl)-6-hydroxyphthalate, dimethyl 4'-acetamido-4-hydroxy-[1,1'-biphenyl]-2,3-dicarboxylate, dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate, Dimethyl 4'-acetamido-4-hydroxy-2,3-biphenyldicarboxylate, dimethyl 3-(4-acetamidophenyl)-6-hydroxybenzene-1,2-dicarboxylate
| Molecular Formula | C18H17NO6 |
|---|---|
| Molecular Weight | 343.11 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 343.1056 |
| Heavy Atoms | 25 |
| Complexity | 500.0 |
Chemical Identifiers
| CAS Number | 69836-66-4 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)C2=C(C(=C(C=C2)O)C(=O)OC)C(=O)OC |
| InChIKey | CWKFHYNLQGTKJG-UHFFFAOYSA-N |
Product Overview
Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate (CAS 69836-66-4), with molecular formula C18H17NO6 and molecular weight 343.11 g/mol. IUPAC: dimethyl 3-(4-acetamidophenyl)-6-hydroxybenzene-1,2-dicarboxylate.
Chemical Property Profile of Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate
Property Insights of Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate. Following Lipinski's Rule of Five, Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate has 2 hydrogen bond donor(s) and 6 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 Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate?
The CAS number of Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate is 69836-66-4.
What is the molecular formula of Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate?
The molecular formula of Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate is C18H17NO6.
What is the molecular weight of Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate?
The molecular weight of Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate is 343.11 g/mol.
Where can I buy Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate?
You can request a quote for Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 4'-(acetylamino)-4-hydroxybiphenyl-2,3-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.