RefChem:561457
TL;DR: RefChem:561457 (CAS 30449-81-1) is a chemical compound with molecular formula C23H29N5O3 and molecular weight 423.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5-cyano-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinyl)diazenyl]-N-(2-ethylhexyl)benzamide
Also Known As: p-[ azo]-N- benzamide, P-[(5-CYANO-1,6-DIHYDRO-2-HYDROXY-1,4-DIMETHYL-6-OXO-3-PYRIDYL)AZO]-N-(2-ETHYLHEXYL)BENZAMIDE, Benzamide, 4-((5-cyano-1,6-dihydro-2-hydroxy-1,4-dimethyl-6-oxo-3-pyridinyl)azo)-N-(2-ethylhexyl)-, Benzamide, 4-(2-(5-cyano-1,6-dihydro-2-hydroxy-1,4-dimethyl-6-oxo-3-pyridinyl)diazenyl)-N-(2-ethylhexyl)-, Benzamide, 4-[(5-cyano-1,6-dihydro-2-hydroxy-1,4-dimethyl-6-oxo-3-pyridinyl)azo]-N-(2-ethylhexyl)-
| Molecular Formula | C23H29N5O3 |
|---|---|
| Molecular Weight | 423.23 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 423.22705 |
| Heavy Atoms | 31 |
| Complexity | 812.0 |
Chemical Identifiers
| CAS Number | 30449-81-1 |
|---|---|
| SMILES | CCCCC(CC)CNC(=O)C1=CC=C(C=C1)N=NC2=C(C(=C(N(C2=O)C)O)C#N)C |
| InChIKey | KYVVXWNORDPBRH-UHFFFAOYSA-N |
Product Overview
RefChem:561457 (CAS 30449-81-1), with molecular formula C23H29N5O3 and molecular weight 423.23 g/mol. IUPAC: 4-[(5-cyano-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinyl)diazenyl]-N-(2-ethylhexyl)benzamide.
Chemical Property Profile of RefChem:561457
Property Insights of RefChem:561457
The XLogP value of 4.5 indicates that RefChem:561457 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:561457. Following Lipinski's Rule of Five, RefChem:561457 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 RefChem:561457?
The CAS number of RefChem:561457 is 30449-81-1.
What is the molecular formula of RefChem:561457?
The molecular formula of RefChem:561457 is C23H29N5O3.
What is the molecular weight of RefChem:561457?
The molecular weight of RefChem:561457 is 423.23 g/mol.
Where can I buy RefChem:561457?
You can request a quote for RefChem:561457 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:561457?
Yes, KEHONG BIO provides custom synthesis services for RefChem:561457 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.