2-Amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile
TL;DR: 2-Amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile (CAS 352554-98-4) is a chemical compound with molecular formula C16H15N3O and molecular weight 265.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile
Also Known As: 2-amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile, BIM-0026938.P001, 2-amino-3-benzoyl-5,6,7,8-tetrahydro-1-indolizinecarbonitrile, AH-262/37240001, 2-amino-3-(phenylcarbonyl)-5,6,7,8-tetrahydroindolizine-1-carbonitrile
| Molecular Formula | C16H15N3O |
|---|---|
| Molecular Weight | 265.12 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 71.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.12152 |
| Heavy Atoms | 20 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 352554-98-4 |
|---|---|
| SMILES | C1CCN2C(=C(C(=C2C(=O)C3=CC=CC=C3)N)C#N)C1 |
| InChIKey | YQXZMOQYAMECQX-UHFFFAOYSA-N |
Product Overview
2-Amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile (CAS 352554-98-4), with molecular formula C16H15N3O and molecular weight 265.12 g/mol. IUPAC: 2-amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile.
Chemical Property Profile of 2-Amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile
Property Insights of 2-Amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile. Following Lipinski's Rule of Five, 2-Amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-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-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile?
The CAS number of 2-Amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile is 352554-98-4.
What is the molecular formula of 2-Amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile?
The molecular formula of 2-Amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile is C16H15N3O.
What is the molecular weight of 2-Amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile?
The molecular weight of 2-Amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile is 265.12 g/mol.
Where can I buy 2-Amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile?
You can request a quote for 2-Amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-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-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-3-benzoyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.