UPCMLD0ENAT5645382:001
TL;DR: UPCMLD0ENAT5645382:001 (CAS 867135-97-5) is a chemical compound with molecular formula C20H18ClN3O4 and molecular weight 399.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(2-chloro-6,7-dimethoxyquinolin-3-yl)-5-(furan-2-yl)-3,4-dihydropyrazol-2-yl]ethanone
Also Known As: UPCMLD0ENAT5645382:001, F1656-0111, 1-[5-(2-chloro-6,7-dimethoxyquinolin-3-yl)-3-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one, 1-[3-(2-chloro-6,7-dimethoxyquinolin-3-yl)-5-(furan-2-yl)-3,4-dihydropyrazol-2-yl]ethanone, 1-(5-(2-chloro-6,7-dimethoxyquinolin-3-yl)-3-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone
| Molecular Formula | C20H18ClN3O4 |
|---|---|
| Molecular Weight | 399.10 g/mol |
| LogP | 4.196 |
| Topological Polar Surface Area | 77.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.09857 |
| Heavy Atoms | 28 |
| Complexity | 1078.7444 |
Chemical Identifiers
| CAS Number | 867135-97-5 |
|---|---|
| SMILES | CC(=O)N1C(CC(=N1)C2=CC=CO2)C3=C(N=C4C=C(C(=CC4=C3)OC)OC)Cl |
Product Overview
UPCMLD0ENAT5645382:001 (CAS 867135-97-5), with molecular formula C20H18ClN3O4 and molecular weight 399.10 g/mol. IUPAC: 1-[3-(2-chloro-6,7-dimethoxyquinolin-3-yl)-5-(furan-2-yl)-3,4-dihydropyrazol-2-yl]ethanone.
Chemical Property Profile of UPCMLD0ENAT5645382:001
Property Insights of UPCMLD0ENAT5645382:001
The XLogP value of 4.196 indicates that UPCMLD0ENAT5645382:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.16 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5645382:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5645382:001 has 0 hydrogen bond donor(s) and 6 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 UPCMLD0ENAT5645382:001?
The CAS number of UPCMLD0ENAT5645382:001 is 867135-97-5.
What is the molecular formula of UPCMLD0ENAT5645382:001?
The molecular formula of UPCMLD0ENAT5645382:001 is C20H18ClN3O4.
What is the molecular weight of UPCMLD0ENAT5645382:001?
The molecular weight of UPCMLD0ENAT5645382:001 is 399.10 g/mol.
Where can I buy UPCMLD0ENAT5645382:001?
You can request a quote for UPCMLD0ENAT5645382:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5645382:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5645382:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.