J1.725.546K
TL;DR: J1.725.546K (CAS 433266-26-3) is a chemical compound with molecular formula C22H18ClN3O2 and molecular weight 391.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-4-imino-9,10-dimethoxy-6,7-dihydrobenzo[a]quinolizine-3-carbonitrile
Also Known As: J1.725.546K, 2-(4-chlorophenyl)-4-imino-9,10-dimethoxy-6,7-dihydro-4H-pyrido[2,1-a]isoquinoline-3-carbonitrile, 2-(4-chlorophenyl)-4-imino-9,10-dimethoxy-6,7-dihydrobenzo[a]quinolizine-3-carbonitrile, 2-(4-chlorophenyl)-4-imino-9,10-dimethoxy-4H,6H,7H-pyrido[2,1-a]isoquinoline-3-carbonitrile, 2-(4-Chlorophenyl)-4-imino-9,10-dimethoxy-6,7-dihydro-4H-benzo[a]quinolizine-3-carbonitrile
| Molecular Formula | C22H18ClN3O2 |
|---|---|
| Molecular Weight | 391.11 g/mol |
| LogP | 4.39995 |
| Topological Polar Surface Area | 71.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 391.10876 |
| Heavy Atoms | 28 |
| Complexity | 1174.3569 |
Chemical Identifiers
| CAS Number | 433266-26-3 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)CCN3C2=CC(=C(C3=N)C#N)C4=CC=C(C=C4)Cl)OC |
Product Overview
J1.725.546K (CAS 433266-26-3), with molecular formula C22H18ClN3O2 and molecular weight 391.11 g/mol. IUPAC: 2-(4-chlorophenyl)-4-imino-9,10-dimethoxy-6,7-dihydrobenzo[a]quinolizine-3-carbonitrile.
Chemical Property Profile of J1.725.546K
Property Insights of J1.725.546K
The XLogP value of 4.39995 indicates that J1.725.546K is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.03 Ų falls within the moderate polarity range, balancing permeability and solubility for J1.725.546K. Following Lipinski's Rule of Five, J1.725.546K has 1 hydrogen bond donor(s) and 4 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 J1.725.546K?
The CAS number of J1.725.546K is 433266-26-3.
What is the molecular formula of J1.725.546K?
The molecular formula of J1.725.546K is C22H18ClN3O2.
What is the molecular weight of J1.725.546K?
The molecular weight of J1.725.546K is 391.11 g/mol.
Where can I buy J1.725.546K?
You can request a quote for J1.725.546K directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J1.725.546K?
Yes, KEHONG BIO provides custom synthesis services for J1.725.546K and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.