WY 48989
TL;DR: WY 48989 (CAS 136917-40-3) is a chemical compound with molecular formula C25H18ClN5 and molecular weight 423.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(7-chloro-2-phenylpyrazolo[4,3-c]quinolin-4-yl)ethylamino]benzonitrile
Also Known As: 4-((2-(7-Chloro-2-phenyl-2H-pyrazolo(4,3-c)quinolin-4-yl)ethyl)amino)benzonitrile, 4-[2-(7-chloro-2-phenylpyrazolo[4,3-c]quinolin-4-yl)ethylamino]benzonitrile, 4-[(2-{7-CHLORO-2-PHENYL-2H-PYRAZOLO[4,3-C]QUINOLIN-4-YL}ETHYL)AMINO]BENZONITRILE, 4-[[2-(7-chloro-2-phenyl-2h-pyrazolo[4,3-c]quinolin-4-yl)ethyl]amino]benzonitrile, 4-[2-[7-Chloro-2-phenyl-2H-pyrazolo[4,3-c]quinolin-4-yl]ethylamino]benzonitrile
| Molecular Formula | C25H18ClN5 |
|---|---|
| Molecular Weight | 423.13 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.12506 |
| Heavy Atoms | 31 |
| Complexity | 635.0 |
Chemical Identifiers
| CAS Number | 136917-40-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=C3C(=NC4=C(C3=N2)C=CC(=C4)Cl)CCNC5=CC=C(C=C5)C#N |
| InChIKey | GYVYUQVVKBZPRY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
WY 48989 (CAS 136917-40-3), with molecular formula C25H18ClN5 and molecular weight 423.13 g/mol. IUPAC: 4-[2-(7-chloro-2-phenylpyrazolo[4,3-c]quinolin-4-yl)ethylamino]benzonitrile.
Chemical Property Profile of WY 48989
Property Insights of WY 48989
The XLogP value of 5.8 indicates that WY 48989 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for WY 48989. Following Lipinski's Rule of Five, WY 48989 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of WY 48989?
The CAS number of WY 48989 is 136917-40-3.
What is the molecular formula of WY 48989?
The molecular formula of WY 48989 is C25H18ClN5.
What is the molecular weight of WY 48989?
The molecular weight of WY 48989 is 423.13 g/mol.
Where can I buy WY 48989?
You can request a quote for WY 48989 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for WY 48989?
Yes, KEHONG BIO provides custom synthesis services for WY 48989 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.