4-Chlorophenylglyoxal nicotinamido-hemiacetal
TL;DR: 4-Chlorophenylglyoxal nicotinamido-hemiacetal (CAS 42069-27-2) is a chemical compound with molecular formula C14H11ClN2O3 and molecular weight 290.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-chlorophenyl)-1-hydroxy-2-oxoethyl]pyridine-3-carboxamide
Also Known As: 4-Chlorophenylglyoxal nicotinamido-hemiacetal, 5-22-02-00095 (Beilstein Handbook Reference), N-(2-(4-Chlorophenyl)-1-hydroxy-2-oxoethyl)-3-pyridinecarboxamide, 3-Pyridinecarboxamide, N-(2-(4-chlorophenyl)-1-hydroxy-2-oxoethyl)-, N-[2-(4-chlorophenyl)-1-hydroxy-2-oxoethyl]pyridine-3-carboxamide
| Molecular Formula | C14H11ClN2O3 |
|---|---|
| Molecular Weight | 290.05 g/mol |
| LogP | 1.6661 |
| Topological Polar Surface Area | 79.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 290.0458 |
| Heavy Atoms | 20 |
| Complexity | 614.076 |
Chemical Identifiers
| CAS Number | 42069-27-2 |
|---|---|
| SMILES | C1=CC(=CN=C1)C(=O)NC(C(=O)C2=CC=C(C=C2)Cl)O |
Product Overview
4-Chlorophenylglyoxal nicotinamido-hemiacetal (CAS 42069-27-2), with molecular formula C14H11ClN2O3 and molecular weight 290.05 g/mol. IUPAC: N-[2-(4-chlorophenyl)-1-hydroxy-2-oxoethyl]pyridine-3-carboxamide.
Chemical Property Profile of 4-Chlorophenylglyoxal nicotinamido-hemiacetal
Property Insights of 4-Chlorophenylglyoxal nicotinamido-hemiacetal
The XLogP value of 1.6661 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chlorophenylglyoxal nicotinamido-hemiacetal. The TPSA of 79.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chlorophenylglyoxal nicotinamido-hemiacetal. Following Lipinski's Rule of Five, 4-Chlorophenylglyoxal nicotinamido-hemiacetal has 2 hydrogen bond donor(s) and 4 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 4-Chlorophenylglyoxal nicotinamido-hemiacetal?
The CAS number of 4-Chlorophenylglyoxal nicotinamido-hemiacetal is 42069-27-2.
What is the molecular formula of 4-Chlorophenylglyoxal nicotinamido-hemiacetal?
The molecular formula of 4-Chlorophenylglyoxal nicotinamido-hemiacetal is C14H11ClN2O3.
What is the molecular weight of 4-Chlorophenylglyoxal nicotinamido-hemiacetal?
The molecular weight of 4-Chlorophenylglyoxal nicotinamido-hemiacetal is 290.05 g/mol.
Where can I buy 4-Chlorophenylglyoxal nicotinamido-hemiacetal?
You can request a quote for 4-Chlorophenylglyoxal nicotinamido-hemiacetal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chlorophenylglyoxal nicotinamido-hemiacetal?
Yes, KEHONG BIO provides custom synthesis services for 4-Chlorophenylglyoxal nicotinamido-hemiacetal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.