![diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate structure](/static/products/1612/161265-88-9.webp)
diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate
TL;DR: diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate (CAS 161265-88-9) is a chemical compound with molecular formula C26H31NO5 and molecular weight 437.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 6-hydroxy-6-methyl-4-(4-methylanilino)-2-phenylcyclohex-3-ene-1,3-dicarboxylate
Also Known As: diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate, diethyl 6-hydroxy-6-methyl-4-(4-methylanilino)-2-phenylcyclohex-3-ene-1,3-dicarboxylate, diethyl 6-hydroxy-6-methyl-4-[(4-methylphenyl)amino]-2-phenyl-3-cyclohexene-1,3-dicarboxylate, diethyl 6-hydroxy-6-methyl-4-[(4-methylphenyl)amino]-2-phenylcyclohex-3-ene-1,3-dicarboxylate
| Molecular Formula | C26H31NO5 |
|---|---|
| Molecular Weight | 437.22 g/mol |
| LogP | 4.34192 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 437.2202 |
| Heavy Atoms | 32 |
| Complexity | 979.0366 |
Chemical Identifiers
| CAS Number | 161265-88-9 |
|---|---|
| SMILES | CCOC(=O)C1C(C(=C(CC1(C)O)NC2=CC=C(C=C2)C)C(=O)OCC)C3=CC=CC=C3 |
Product Overview
diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate (CAS 161265-88-9), with molecular formula C26H31NO5 and molecular weight 437.22 g/mol. IUPAC: diethyl 6-hydroxy-6-methyl-4-(4-methylanilino)-2-phenylcyclohex-3-ene-1,3-dicarboxylate.
Chemical Property Profile of diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate
Property Insights of diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate
The XLogP value of 4.34192 indicates that diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate. Following Lipinski's Rule of Five, diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-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 diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate?
The CAS number of diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate is 161265-88-9.
What is the molecular formula of diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate?
The molecular formula of diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate is C26H31NO5.
What is the molecular weight of diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate?
The molecular weight of diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate is 437.22 g/mol.
Where can I buy diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate?
You can request a quote for diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for diethyl 3-hydroxy-3-methyl-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.