(p-nitrophenyl)glyoxylic acid
TL;DR: (p-nitrophenyl)glyoxylic acid (CAS 149221-14-7) is a chemical compound with molecular formula C14H15ClN2O3 and molecular weight 294.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(5-chloro-2-pyridinyl)amino]-6-methyl-2-oxocyclohex-3-ene-1-carboxylate
Also Known As: (p-nitrophenyl)glyoxylic acid, Methyl 4-((5-chloro-2-pyridinyl)amino)-6-methyl-2-oxo-3-cyclohexene-1-carboxylate, 3-Cyclohexene-1-carboxylic acid, 4-((5-chloro-2-pyridinyl)amino)-6-methyl-2-oxo-, methyl ester, methyl 4-[(5-chloropyridin-2-yl)amino]-6-methyl-2-oxocyclohex-3-ene-1-carboxylate, 3-Cyclohexene-1-carboxylicacid, 4-[(5-chloro-2-pyridinyl)amino]-6-methyl-2-oxo-, methyl ester
| Molecular Formula | C14H15ClN2O3 |
|---|---|
| Molecular Weight | 294.08 g/mol |
| LogP | 2.4289 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 294.07712 |
| Heavy Atoms | 20 |
| Complexity | 554.04236 |
Chemical Identifiers
| CAS Number | 149221-14-7 |
|---|---|
| SMILES | CC1CC(=CC(=O)C1C(=O)OC)NC2=NC=C(C=C2)Cl |
Product Overview
(p-nitrophenyl)glyoxylic acid (CAS 149221-14-7), with molecular formula C14H15ClN2O3 and molecular weight 294.08 g/mol. IUPAC: methyl 4-[(5-chloro-2-pyridinyl)amino]-6-methyl-2-oxocyclohex-3-ene-1-carboxylate.
Chemical Property Profile of (p-nitrophenyl)glyoxylic acid
Property Insights of (p-nitrophenyl)glyoxylic acid
The XLogP value of 2.4289 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (p-nitrophenyl)glyoxylic acid. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for (p-nitrophenyl)glyoxylic acid. Following Lipinski's Rule of Five, (p-nitrophenyl)glyoxylic acid has 1 hydrogen bond donor(s) and 5 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 (p-nitrophenyl)glyoxylic acid?
The CAS number of (p-nitrophenyl)glyoxylic acid is 149221-14-7.
What is the molecular formula of (p-nitrophenyl)glyoxylic acid?
The molecular formula of (p-nitrophenyl)glyoxylic acid is C14H15ClN2O3.
What is the molecular weight of (p-nitrophenyl)glyoxylic acid?
The molecular weight of (p-nitrophenyl)glyoxylic acid is 294.08 g/mol.
Where can I buy (p-nitrophenyl)glyoxylic acid?
You can request a quote for (p-nitrophenyl)glyoxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (p-nitrophenyl)glyoxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (p-nitrophenyl)glyoxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.