2-Amino-3-benzoylindolizine-1-carbonitrile
TL;DR: 2-Amino-3-benzoylindolizine-1-carbonitrile (CAS 63014-77-7) is a chemical compound with molecular formula C16H11N3O and molecular weight 261.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3-benzoylindolizine-1-carbonitrile
Also Known As: 2-amino-3-benzoylindolizine-1-carbonitrile, AI-204/31727063, J2.547.553D, 2-amino-3-(phenylcarbonyl)indolizine-1-carbonitrile
| Molecular Formula | C16H11N3O |
|---|---|
| Molecular Weight | 261.09 g/mol |
| LogP | 2.62418 |
| Topological Polar Surface Area | 71.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.0902 |
| Heavy Atoms | 20 |
| Complexity | 841.27966 |
Chemical Identifiers
| CAS Number | 63014-77-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=C(C(=C3N2C=CC=C3)C#N)N |
Product Overview
2-Amino-3-benzoylindolizine-1-carbonitrile (CAS 63014-77-7), with molecular formula C16H11N3O and molecular weight 261.09 g/mol. IUPAC: 2-amino-3-benzoylindolizine-1-carbonitrile.
Chemical Property Profile of 2-Amino-3-benzoylindolizine-1-carbonitrile
Property Insights of 2-Amino-3-benzoylindolizine-1-carbonitrile
The XLogP value of 2.62418 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-3-benzoylindolizine-1-carbonitrile. The TPSA of 71.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-3-benzoylindolizine-1-carbonitrile. Following Lipinski's Rule of Five, 2-Amino-3-benzoylindolizine-1-carbonitrile 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 2-Amino-3-benzoylindolizine-1-carbonitrile?
The CAS number of 2-Amino-3-benzoylindolizine-1-carbonitrile is 63014-77-7.
What is the molecular formula of 2-Amino-3-benzoylindolizine-1-carbonitrile?
The molecular formula of 2-Amino-3-benzoylindolizine-1-carbonitrile is C16H11N3O.
What is the molecular weight of 2-Amino-3-benzoylindolizine-1-carbonitrile?
The molecular weight of 2-Amino-3-benzoylindolizine-1-carbonitrile is 261.09 g/mol.
Where can I buy 2-Amino-3-benzoylindolizine-1-carbonitrile?
You can request a quote for 2-Amino-3-benzoylindolizine-1-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-3-benzoylindolizine-1-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-3-benzoylindolizine-1-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.