4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)-
TL;DR: 4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)- (CAS 119584-89-3) is a chemical compound with molecular formula C12H8ClN3O2 and molecular weight 261.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-(2-methyltriazol-4-yl)chromen-4-one
Also Known As: 4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)-, 6-chloro-2-(2-methyltriazol-4-yl)chromen-4-one, 6-Chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)-4H-1-benzopyran-4-one, 6-Chloro-2-(2-methyl-2H-1,2,3-triazol-4-yl)-4H-1-benzopyran-4-one, BRN 4194863
| Molecular Formula | C12H8ClN3O2 |
|---|---|
| Molecular Weight | 261.03 g/mol |
| LogP | 2.2419 |
| Topological Polar Surface Area | 60.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 261.03052 |
| Heavy Atoms | 18 |
| Complexity | 791.362 |
Chemical Identifiers
| CAS Number | 119584-89-3 |
|---|---|
| SMILES | CN1N=CC(=N1)C2=CC(=O)C3=C(O2)C=CC(=C3)Cl |
Product Overview
4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)- (CAS 119584-89-3), with molecular formula C12H8ClN3O2 and molecular weight 261.03 g/mol. IUPAC: 6-chloro-2-(2-methyltriazol-4-yl)chromen-4-one.
Chemical Property Profile of 4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)-
Property Insights of 4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)-
The XLogP value of 2.2419 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)-. The TPSA of 60.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)-. Following Lipinski's Rule of Five, 4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)- has 0 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 4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)-?
The CAS number of 4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)- is 119584-89-3.
What is the molecular formula of 4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)-?
The molecular formula of 4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)- is C12H8ClN3O2.
What is the molecular weight of 4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)-?
The molecular weight of 4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)- is 261.03 g/mol.
Where can I buy 4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)-?
You can request a quote for 4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)-?
Yes, KEHONG BIO provides custom synthesis services for 4H-1-Benzopyran-4-one, 6-chloro-2-(2-methyl-1H-1,2,3-triazol-4-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.