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Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]-
TL;DR: Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]- (CAS 72953-48-1) is a chemical compound with molecular formula C16H11ClN4 and molecular weight 294.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-4-[(2-methyl-1H-indol-3-yl)diazenyl]benzonitrile
Also Known As: 2-CHLORO-4-[(2-METHYL-1H-INDOL-3-YL)AZO]BENZONITRILE, 3-((3-Chloro-4-cyanophenyl)azo)-2-methylindole, Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]-, 3-((3-Chloro-4-cyanophenyl)azo)-2-methyl-1H-indole, Benzonitrile, 2-chloro-4-((2-methyl-1H-indol-3-yl)azo)-
| Molecular Formula | C16H11ClN4 |
|---|---|
| Molecular Weight | 294.07 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 64.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.06723 |
| Heavy Atoms | 21 |
| Complexity | 443.0 |
Chemical Identifiers
| CAS Number | 72953-48-1 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1)N=NC3=CC(=C(C=C3)C#N)Cl |
| InChIKey | LCELEDSEURRAOS-UHFFFAOYSA-N |
Product Overview
Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]- (CAS 72953-48-1), with molecular formula C16H11ClN4 and molecular weight 294.07 g/mol. IUPAC: 2-chloro-4-[(2-methyl-1H-indol-3-yl)diazenyl]benzonitrile.
Chemical Property Profile of Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]-
Property Insights of Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]-
The XLogP value of 4.6 indicates that Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]-. Following Lipinski's Rule of Five, Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]- has 1 hydrogen bond donor(s) and 3 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 Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]-?
The CAS number of Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]- is 72953-48-1.
What is the molecular formula of Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]-?
The molecular formula of Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]- is C16H11ClN4.
What is the molecular weight of Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]-?
The molecular weight of Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]- is 294.07 g/mol.
Where can I buy Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]-?
You can request a quote for Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]-?
Yes, KEHONG BIO provides custom synthesis services for Benzonitrile, 2-chloro-4-[(2-methyl-1H-indol-3-yl)azo]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.