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Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate
TL;DR: Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate (CAS 700360-10-7) is a chemical compound with molecular formula C16H17NO2 and molecular weight 255.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[4-(dimethylamino)phenyl]benzoate
Also Known As: Methyl 3-(4-dimethylaminophenyl)benzoate, Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate, BB 0222648, J2.174.069A, methyl 4'-(dimethylamino)[1,1'-biphenyl]-3-carboxylate
| Molecular Formula | C16H17NO2 |
|---|---|
| Molecular Weight | 255.13 g/mol |
| LogP | 3.2062 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 255.12593 |
| Heavy Atoms | 19 |
| Complexity | 573.55774 |
Chemical Identifiers
| CAS Number | 700360-10-7 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C2=CC(=CC=C2)C(=O)OC |
Product Overview
Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate (CAS 700360-10-7), with molecular formula C16H17NO2 and molecular weight 255.13 g/mol. IUPAC: methyl 3-[4-(dimethylamino)phenyl]benzoate.
Chemical Property Profile of Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate
Property Insights of Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate
The XLogP value of 3.2062 indicates that Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate has 0 hydrogen bond donor(s) and 3 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 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate?
The CAS number of Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate is 700360-10-7.
What is the molecular formula of Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate?
The molecular formula of Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate is C16H17NO2.
What is the molecular weight of Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate?
The molecular weight of Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate is 255.13 g/mol.
Where can I buy Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate?
You can request a quote for Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4'-(dimethylamino)-[1,1'-biphenyl]-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.