1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline
TL;DR: 1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline (CAS 13226-13-6) is a chemical compound with molecular formula C19H13N3O and molecular weight 299.10587 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline
Also Known As: 1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline, 1-(4-nitroso-5-phenyl-pyrrol-2-yl)-isoquinoline, Isoquinoline, 1-(4-nitroso-5-phenyl-1H-pyrrol-2-yl)-, NSC 116655, L7EK272PE4
Technical Specifications
| Molecular Formula | C19H13N3O |
| Molecular Weight | 299.10587 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 58.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 299.10587 Da |
| Heavy Atoms | 23 |
| Complexity | 409.0 |
| SMILES | C1=CC=C(C=C1)C2=C(C=C(N2)C3=NC=CC4=CC=CC=C43)N=O |
| InChIKey | BDXUZIQIBQWJJH-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline
Property Insights of 1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline
The XLogP value of 3.6 indicates that 1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.1 Ų, 1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline 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
What is the CAS number of 1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline?
The CAS number of 1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline is 13226-13-6.
What is the molecular formula of 1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline?
The molecular formula of 1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline is C19H13N3O.
What is the molecular weight of 1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline?
The molecular weight of 1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline is 299.10587 g/mol.
Where can I buy 1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline?
You can request a quote for 1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline?
Yes, CoreyChem provides custom synthesis services for 1-(4-Nitroso-5-phenyl-1H-pyrrol-2-yl)isoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.