ChemDiv1_013562
TL;DR: ChemDiv1_013562 (CAS 422289-87-0) is a chemical compound with molecular formula C24H20BrN5O3S2 and molecular weight 569.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-bromobenzimidazolo[1,2-c]quinazolin-6-yl)sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Also Known As: ChemDiv1_013562, F3168-1897, 2-({4-bromo-8,10,17-triazatetracyclo[8.7.0.0^{2,7}.0^{11,16}]heptadeca-1(17),2(7),3,5,8,11(16),12,14-octaen-9-yl}sulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide, 2-((2-bromobenzo[4,5]imidazo[1,2-c]quinazolin-6-yl)thio)-N-(4-sulfamoylphenethyl)acetamide, 2-(2-bromobenzimidazolo[1,2-c]quinazolin-6-yl)sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
| Molecular Formula | C24H20BrN5O3S2 |
|---|---|
| Molecular Weight | 569.02 g/mol |
| LogP | 3.8966 |
| Topological Polar Surface Area | 119.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 569.0191 |
| Heavy Atoms | 35 |
| Complexity | 1685.2141 |
Chemical Identifiers
| CAS Number | 422289-87-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C3N2C(=NC4=C3C=C(C=C4)Br)SCC(=O)NCCC5=CC=C(C=C5)S(=O)(=O)N |
Product Overview
ChemDiv1_013562 (CAS 422289-87-0), with molecular formula C24H20BrN5O3S2 and molecular weight 569.02 g/mol. IUPAC: 2-(2-bromobenzimidazolo[1,2-c]quinazolin-6-yl)sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide.
Chemical Property Profile of ChemDiv1_013562
Property Insights of ChemDiv1_013562
The XLogP value of 3.8966 indicates that ChemDiv1_013562 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.45 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_013562. Following Lipinski's Rule of Five, ChemDiv1_013562 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_013562?
The CAS number of ChemDiv1_013562 is 422289-87-0.
What is the molecular formula of ChemDiv1_013562?
The molecular formula of ChemDiv1_013562 is C24H20BrN5O3S2.
What is the molecular weight of ChemDiv1_013562?
The molecular weight of ChemDiv1_013562 is 569.02 g/mol.
Where can I buy ChemDiv1_013562?
You can request a quote for ChemDiv1_013562 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_013562?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_013562 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.