RefChem:512143
TL;DR: RefChem:512143 (CAS 309276-99-1) is a chemical compound with molecular formula C20H17BrN4O3S2 and molecular weight 503.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-amino-4-(5-bromothiophen-2-yl)-3-cyano-5-oxo-4,6,7,8-tetrahydroquinolin-1-yl]benzenesulfonamide
Also Known As: A2122/0089064, 4-(2-Amino-4-(5-bromothiophen-2-yl)-3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-1(4H)-yl)benzenesulfonamide, 4-(2-AMINO-4-(5-BROMO-2-THIENYL)-3-CYANO-5-OXO-5,6,7,8-TETRAHYDRO-1(4H)-QUINOLINYL)BENZENESULFONAMIDE, 4-[2-AMINO-4-(5-BROMOTHIOPHEN-2-YL)-3-CYANO-5-OXO-1,4,5,6,7,8-HEXAHYDROQUINOLIN-1-YL]BENZENE-1-SULFONAMIDE, 4-[2-amino-4-(5-bromothiophen-2-yl)-3-cyano-5-oxo-4,6,7,8-tetrahydroquinolin-1-yl]benzenesulfonamide
| Molecular Formula | C20H17BrN4O3S2 |
|---|---|
| Molecular Weight | 503.99 g/mol |
| LogP | 3.46278 |
| Topological Polar Surface Area | 130.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 503.99255 |
| Heavy Atoms | 30 |
| Complexity | 1253.7102 |
Chemical Identifiers
| CAS Number | 309276-99-1 |
|---|---|
| SMILES | C1CC2=C(C(C(=C(N2C3=CC=C(C=C3)S(=O)(=O)N)N)C#N)C4=CC=C(S4)Br)C(=O)C1 |
Product Overview
RefChem:512143 (CAS 309276-99-1), with molecular formula C20H17BrN4O3S2 and molecular weight 503.99 g/mol. IUPAC: 4-[2-amino-4-(5-bromothiophen-2-yl)-3-cyano-5-oxo-4,6,7,8-tetrahydroquinolin-1-yl]benzenesulfonamide.
Chemical Property Profile of RefChem:512143
Property Insights of RefChem:512143
The XLogP value of 3.46278 indicates that RefChem:512143 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.28 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:512143. Following Lipinski's Rule of Five, RefChem:512143 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:512143?
The CAS number of RefChem:512143 is 309276-99-1.
What is the molecular formula of RefChem:512143?
The molecular formula of RefChem:512143 is C20H17BrN4O3S2.
What is the molecular weight of RefChem:512143?
The molecular weight of RefChem:512143 is 503.99 g/mol.
Where can I buy RefChem:512143?
You can request a quote for RefChem:512143 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:512143?
Yes, KEHONG BIO provides custom synthesis services for RefChem:512143 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.