C22H19ClN4O5S
TL;DR: C22H19ClN4O5S (CAS 867042-44-2) is a chemical compound with molecular formula C22H19ClN4O5S and molecular weight 486.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[2-acetyl-3-(6-chloro-[1,3]dioxolo[4,5-g]quinolin-7-yl)-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide
Also Known As: F1635-0086, N-(3-(1-acetyl-5-(6-chloro-[1,3]dioxolo[4,5-g]quinolin-7-yl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl)methanesulfonamide, N-[3-[2-acetyl-3-(6-chloro-[1,3]dioxolo[4,5-g]quinolin-7-yl)-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide, N-{3-[1-acetyl-5-(6-chloro[1,3]dioxolo[4,5-g]quinolin-7-yl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl}methanesulfonamide, 1-acetyl-5-(6-chloro(2H-1,3-dioxolano[4,5-g]quinolin-7-yl))-3-{3-[(methylsulfo nyl)amino]phenyl}-2-pyrazoline
| Molecular Formula | C22H19ClN4O5S |
|---|---|
| Molecular Weight | 486.08 g/mol |
| LogP | 3.686 |
| Topological Polar Surface Area | 110.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 486.07648 |
| Heavy Atoms | 33 |
| Complexity | 1440.217 |
Chemical Identifiers
| CAS Number | 867042-44-2 |
|---|---|
| SMILES | CC(=O)N1C(CC(=N1)C2=CC(=CC=C2)NS(=O)(=O)C)C3=C(N=C4C=C5C(=CC4=C3)OCO5)Cl |
Product Overview
C22H19ClN4O5S (CAS 867042-44-2), with molecular formula C22H19ClN4O5S and molecular weight 486.08 g/mol. IUPAC: N-[3-[2-acetyl-3-(6-chloro-[1,3]dioxolo[4,5-g]quinolin-7-yl)-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide.
Chemical Property Profile of C22H19ClN4O5S
Property Insights of C22H19ClN4O5S
The XLogP value of 3.686 indicates that C22H19ClN4O5S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.19 Ų falls within the moderate polarity range, balancing permeability and solubility for C22H19ClN4O5S. Following Lipinski's Rule of Five, C22H19ClN4O5S has 1 hydrogen bond donor(s) and 7 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 C22H19ClN4O5S?
The CAS number of C22H19ClN4O5S is 867042-44-2.
What is the molecular formula of C22H19ClN4O5S?
The molecular formula of C22H19ClN4O5S is C22H19ClN4O5S.
What is the molecular weight of C22H19ClN4O5S?
The molecular weight of C22H19ClN4O5S is 486.08 g/mol.
Where can I buy C22H19ClN4O5S?
You can request a quote for C22H19ClN4O5S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C22H19ClN4O5S?
Yes, KEHONG BIO provides custom synthesis services for C22H19ClN4O5S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.