(2-cyanophenyl)methyl 1H-indazole-3-carboxylate
TL;DR: (2-cyanophenyl)methyl 1H-indazole-3-carboxylate (CAS 930962-74-6) is a chemical compound with molecular formula C16H11N3O2 and molecular weight 277.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-cyanophenyl)methyl 1H-indazole-3-carboxylate
Also Known As: (2-cyanophenyl)methyl 1H-indazole-3-carboxylate, (2-cyanophenyl)methyl-1h-indazole-3-carboxylate
| Molecular Formula | C16H11N3O2 |
|---|---|
| Molecular Weight | 277.09 g/mol |
| LogP | 2.79158 |
| Topological Polar Surface Area | 78.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.0851 |
| Heavy Atoms | 21 |
| Complexity | 845.8494 |
Chemical Identifiers
| CAS Number | 930962-74-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)COC(=O)C2=NNC3=CC=CC=C32)C#N |
Product Overview
(2-cyanophenyl)methyl 1H-indazole-3-carboxylate (CAS 930962-74-6), with molecular formula C16H11N3O2 and molecular weight 277.09 g/mol. IUPAC: (2-cyanophenyl)methyl 1H-indazole-3-carboxylate.
Chemical Property Profile of (2-cyanophenyl)methyl 1H-indazole-3-carboxylate
Property Insights of (2-cyanophenyl)methyl 1H-indazole-3-carboxylate
The XLogP value of 2.79158 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-cyanophenyl)methyl 1H-indazole-3-carboxylate. The TPSA of 78.77 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-cyanophenyl)methyl 1H-indazole-3-carboxylate. Following Lipinski's Rule of Five, (2-cyanophenyl)methyl 1H-indazole-3-carboxylate has 1 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 (2-cyanophenyl)methyl 1H-indazole-3-carboxylate?
The CAS number of (2-cyanophenyl)methyl 1H-indazole-3-carboxylate is 930962-74-6.
What is the molecular formula of (2-cyanophenyl)methyl 1H-indazole-3-carboxylate?
The molecular formula of (2-cyanophenyl)methyl 1H-indazole-3-carboxylate is C16H11N3O2.
What is the molecular weight of (2-cyanophenyl)methyl 1H-indazole-3-carboxylate?
The molecular weight of (2-cyanophenyl)methyl 1H-indazole-3-carboxylate is 277.09 g/mol.
Where can I buy (2-cyanophenyl)methyl 1H-indazole-3-carboxylate?
You can request a quote for (2-cyanophenyl)methyl 1H-indazole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-cyanophenyl)methyl 1H-indazole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (2-cyanophenyl)methyl 1H-indazole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.