Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate
TL;DR: Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate (CAS 887112-71-2) is a chemical compound with molecular formula C20H27NO6 and molecular weight 377.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-pyridin-2-ylcyclohexane-1,3-dicarboxylate
Also Known As: Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate, AT-057/41675250, dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-pyridin-2-ylcyclohexane-1,3-dicarboxylate, diisopropyl 4-hydroxy-4-methyl-6-oxo-2-(2-pyridinyl)-1,3-cyclohexanedicarboxylate, Di(propan-2-yl) 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate
| Molecular Formula | C20H27NO6 |
|---|---|
| Molecular Weight | 377.18 g/mol |
| LogP | 2.0246 |
| Topological Polar Surface Area | 102.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 377.18384 |
| Heavy Atoms | 27 |
| Complexity | 689.6833 |
Chemical Identifiers
| CAS Number | 887112-71-2 |
|---|---|
| SMILES | CC(C)OC(=O)C1C(C(C(CC1=O)(C)O)C(=O)OC(C)C)C2=CC=CC=N2 |
Product Overview
Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate (CAS 887112-71-2), with molecular formula C20H27NO6 and molecular weight 377.18 g/mol. IUPAC: dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-pyridin-2-ylcyclohexane-1,3-dicarboxylate.
Chemical Property Profile of Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate
Property Insights of Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate
The XLogP value of 2.0246 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate. The TPSA of 102.79 Ų falls within the moderate polarity range, balancing permeability and solubility for Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate. Following Lipinski's Rule of Five, Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate 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 Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate?
The CAS number of Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate is 887112-71-2.
What is the molecular formula of Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate?
The molecular formula of Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate is C20H27NO6.
What is the molecular weight of Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate?
The molecular weight of Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate is 377.18 g/mol.
Where can I buy Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate?
You can request a quote for Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dipropan-2-yl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-2-yl)cyclohexane-1,3-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.