3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile
TL;DR: 3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile (CAS 790719-65-2) is a chemical compound with molecular formula C14H9N3 and molecular weight 219.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-imino-5-phenylpyrrolizine-2-carbonitrile
Also Known As: 3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile, 3-imino-5-phenylpyrrolizine-2-carbonitrile, VU0612860-1, F3375-0551
| Molecular Formula | C14H9N3 |
|---|---|
| Molecular Weight | 219.08 g/mol |
| LogP | 2.90105 |
| Topological Polar Surface Area | 52.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 219.07965 |
| Heavy Atoms | 17 |
| Complexity | 669.23804 |
Chemical Identifiers
| CAS Number | 790719-65-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C3N2C(=N)C(=C3)C#N |
Product Overview
3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile (CAS 790719-65-2), with molecular formula C14H9N3 and molecular weight 219.08 g/mol. IUPAC: 3-imino-5-phenylpyrrolizine-2-carbonitrile.
Chemical Property Profile of 3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile
Property Insights of 3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile
The XLogP value of 2.90105 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile. With a topological polar surface area (TPSA) of 52.57 Ų, 3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile has 1 hydrogen bond donor(s) and 2 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 3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile?
The CAS number of 3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile is 790719-65-2.
What is the molecular formula of 3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile?
The molecular formula of 3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile is C14H9N3.
What is the molecular weight of 3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile?
The molecular weight of 3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile is 219.08 g/mol.
Where can I buy 3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile?
You can request a quote for 3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-imino-5-phenyl-3H-pyrrolizine-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.