Usp22-IN-1
TL;DR: Usp22-IN-1 (CAS 309735-96-4) is a chemical compound with molecular formula C22H18N4 and molecular weight 338.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-anilino-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile
Also Known As: USP22-IN-1, Usp22i-S02, Usp22i-S02?, BAS 00588915, 11-(Phenylamino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile
| Molecular Formula | C22H18N4 |
|---|---|
| Molecular Weight | 338.15 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 53.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 338.15314 |
| Heavy Atoms | 26 |
| Complexity | 548.0 |
Chemical Identifiers
| CAS Number | 309735-96-4 |
|---|---|
| SMILES | C1CCC2=C(N3C4=CC=CC=C4N=C3C(=C2C1)C#N)NC5=CC=CC=C5 |
| InChIKey | MAWNMDSAHSUPFA-UHFFFAOYSA-N |
Product Overview
Usp22-IN-1 (CAS 309735-96-4), with molecular formula C22H18N4 and molecular weight 338.15 g/mol. IUPAC: 11-anilino-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile.
Chemical Property Profile of Usp22-IN-1
Property Insights of Usp22-IN-1
The XLogP value of 6.2 indicates that Usp22-IN-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.1 Ų, Usp22-IN-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Usp22-IN-1 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Usp22-IN-1?
The CAS number of Usp22-IN-1 is 309735-96-4.
What is the molecular formula of Usp22-IN-1?
The molecular formula of Usp22-IN-1 is C22H18N4.
What is the molecular weight of Usp22-IN-1?
The molecular weight of Usp22-IN-1 is 338.15 g/mol.
Where can I buy Usp22-IN-1?
You can request a quote for Usp22-IN-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Usp22-IN-1?
Yes, KEHONG BIO provides custom synthesis services for Usp22-IN-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.