3-{4-Nitrophenyl}indolizine-1-carbonitrile
TL;DR: 3-{4-Nitrophenyl}indolizine-1-carbonitrile (CAS 158670-19-0) is a chemical compound with molecular formula C15H9N3O2 and molecular weight 263.0695 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-nitrophenyl)indolizine-1-carbonitrile
Also Known As: 3-{4-Nitrophenyl}, 3-{4-nitrophenyl}indolizine-1-carbonitrile, 3-(4-Nitrophenyl)-1-indolizinecarbonitrile, 3-(4-nitrophenyl)indolizine-1-carbonitrile, AA-504/31992025
Technical Specifications
| Molecular Formula | C15H9N3O2 |
| Molecular Weight | 263.0695 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 74.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 263.0695 Da |
| Heavy Atoms | 20 |
| Complexity | 417.0 |
| SMILES | C1=CC2=C(C=C(N2C=C1)C3=CC=C(C=C3)[N+](=O)[O-])C#N |
| InChIKey | PNBZSKPEMLXYEL-UHFFFAOYSA-N |
Chemical Property Profile of 3-{4-Nitrophenyl}indolizine-1-carbonitrile
Property Insights of 3-{4-Nitrophenyl}indolizine-1-carbonitrile
The XLogP value of 3.7 indicates that 3-{4-Nitrophenyl}indolizine-1-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{4-Nitrophenyl}indolizine-1-carbonitrile. Following Lipinski's Rule of Five, 3-{4-Nitrophenyl}indolizine-1-carbonitrile has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-{4-Nitrophenyl}indolizine-1-carbonitrile?
The CAS number of 3-{4-Nitrophenyl}indolizine-1-carbonitrile is 158670-19-0.
What is the molecular formula of 3-{4-Nitrophenyl}indolizine-1-carbonitrile?
The molecular formula of 3-{4-Nitrophenyl}indolizine-1-carbonitrile is C15H9N3O2.
What is the molecular weight of 3-{4-Nitrophenyl}indolizine-1-carbonitrile?
The molecular weight of 3-{4-Nitrophenyl}indolizine-1-carbonitrile is 263.0695 g/mol.
Where can I buy 3-{4-Nitrophenyl}indolizine-1-carbonitrile?
You can request a quote for 3-{4-Nitrophenyl}indolizine-1-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-{4-Nitrophenyl}indolizine-1-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 3-{4-Nitrophenyl}indolizine-1-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.