RefChem:521845
TL;DR: RefChem:521845 (CAS 477732-71-1) is a chemical compound with molecular formula C29H21ClFN5O3S and molecular weight 573.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-chlorophenyl)sulfonylamino]-N-[(E)-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methylideneamino]benzamide
Also Known As: 4-Chloro-N-(4-(2-((3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)hydrazinecarbonyl)phenyl)benzenesulfonamide, 4-CHLORO-N-{4-[((2E)-2-{[3-(4-FLUOROPHENYL)-1-PHENYL-1H-PYRAZOL-4-YL]METHYLENE}HYDRAZINO)CARBONYL]PHENYL}BENZENESULFONAMIDE, 4-CHLORO-N-(4-(((2E)-2-((3-(4-FLUOROPHENYL)-1-PHENYL-1H-PYRAZOL-4-YL)METHYLENE)HYDRAZINO)CARBONYL)PHENYL)BENZENESULFONAMIDE, 647-392-5, RefChem:521845
| Molecular Formula | C29H21ClFN5O3S |
|---|---|
| Molecular Weight | 573.10 g/mol |
| LogP | 5.8965 |
| Topological Polar Surface Area | 105.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 573.10376 |
| Heavy Atoms | 40 |
| Complexity | 1772.9724 |
Chemical Identifiers
| CAS Number | 477732-71-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)F)/C=N/NC(=O)C4=CC=C(C=C4)NS(=O)(=O)C5=CC=C(C=C5)Cl |
Product Overview
RefChem:521845 (CAS 477732-71-1), with molecular formula C29H21ClFN5O3S and molecular weight 573.10 g/mol. IUPAC: 4-[(4-chlorophenyl)sulfonylamino]-N-[(E)-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methylideneamino]benzamide.
Chemical Property Profile of RefChem:521845
Property Insights of RefChem:521845
The XLogP value of 5.8965 indicates that RefChem:521845 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.45 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:521845. Following Lipinski's Rule of Five, RefChem:521845 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:521845?
The CAS number of RefChem:521845 is 477732-71-1.
What is the molecular formula of RefChem:521845?
The molecular formula of RefChem:521845 is C29H21ClFN5O3S.
What is the molecular weight of RefChem:521845?
The molecular weight of RefChem:521845 is 573.10 g/mol.
Where can I buy RefChem:521845?
You can request a quote for RefChem:521845 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:521845?
Yes, KEHONG BIO provides custom synthesis services for RefChem:521845 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.