RefChem:412884
TL;DR: RefChem:412884 (CAS 75198-96-8) is a chemical compound with molecular formula C20H21N5 and molecular weight 331.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(diethylamino)-2-methylphenyl]diazenyl]-5-methylbenzene-1,3-dicarbonitrile
Also Known As: 2-[[4-(diethylamino)-2-methylphenyl]azo]-5-methylbenzene-1,3-dicarbonitrile, 4-((2,6-Dicyano-4-methylphenyl)azo)-3-methyl-N,N-diethylbenzenamine, 1,3-Benzenedicarbonitrile, 2-((4-(diethylamino)-2-methylphenyl)azo)-5-methyl-, 1,3-Benzenedicarbonitrile, 2-[[4-(diethylamino)-2-methylphenyl]azo]-5-methyl-, 2-((4-(Diethylamino)-2-methylphenyl)azo)-5-methylbenzene-1,3-dicarbonitrile
| Molecular Formula | C20H21N5 |
|---|---|
| Molecular Weight | 331.18 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 75.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.1797 |
| Heavy Atoms | 25 |
| Complexity | 523.0 |
Chemical Identifiers
| CAS Number | 75198-96-8 |
|---|---|
| SMILES | CCN(CC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2C#N)C)C#N)C |
| InChIKey | JZTRIZGUGUEXRN-UHFFFAOYSA-N |
Product Overview
RefChem:412884 (CAS 75198-96-8), with molecular formula C20H21N5 and molecular weight 331.18 g/mol. IUPAC: 2-[[4-(diethylamino)-2-methylphenyl]diazenyl]-5-methylbenzene-1,3-dicarbonitrile.
Chemical Property Profile of RefChem:412884
Property Insights of RefChem:412884
The XLogP value of 4.7 indicates that RefChem:412884 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.5 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:412884. Following Lipinski's Rule of Five, RefChem:412884 has 0 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 RefChem:412884?
The CAS number of RefChem:412884 is 75198-96-8.
What is the molecular formula of RefChem:412884?
The molecular formula of RefChem:412884 is C20H21N5.
What is the molecular weight of RefChem:412884?
The molecular weight of RefChem:412884 is 331.18 g/mol.
Where can I buy RefChem:412884?
You can request a quote for RefChem:412884 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:412884?
Yes, KEHONG BIO provides custom synthesis services for RefChem:412884 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.