3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide
TL;DR: 3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide (CAS 488747-69-9) is a chemical compound with molecular formula C21H16ClFN6O4S2 and molecular weight 534.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-6-fluoro-N-[[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]carbamothioyl]-1H-indole-2-carboxamide
Also Known As: 3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide, 3-chloro-6-fluoro-N-({4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl}carbamothioyl)-1H-indole-2-carboxamide, 3-chloro-6-fluoro-N-[[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]carbamothioyl]-1H-indole-2-carboxamide
| Molecular Formula | C21H16ClFN6O4S2 |
|---|---|
| Molecular Weight | 534.03 g/mol |
| LogP | 3.6866 |
| Topological Polar Surface Area | 138.1 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 534.0347 |
| Heavy Atoms | 35 |
| Complexity | 1543.4634 |
Chemical Identifiers
| CAS Number | 488747-69-9 |
|---|---|
| SMILES | COC1=NC=CN=C1NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=C(C4=C(N3)C=C(C=C4)F)Cl |
Product Overview
3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide (CAS 488747-69-9), with molecular formula C21H16ClFN6O4S2 and molecular weight 534.03 g/mol. IUPAC: 3-chloro-6-fluoro-N-[[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]carbamothioyl]-1H-indole-2-carboxamide.
Chemical Property Profile of 3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide
Property Insights of 3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide
The XLogP value of 3.6866 indicates that 3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide. Following Lipinski's Rule of Five, 3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide has 4 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 3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide?
The CAS number of 3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide is 488747-69-9.
What is the molecular formula of 3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide?
The molecular formula of 3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide is C21H16ClFN6O4S2.
What is the molecular weight of 3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide?
The molecular weight of 3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide is 534.03 g/mol.
Where can I buy 3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide?
You can request a quote for 3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-6-fluoro-N-((4-(N-(3-methoxypyrazin-2-yl)sulfamoyl)phenyl)carbamothioyl)-1H-indole-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.