6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide
TL;DR: 6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide (CAS 694501-55-8) is a chemical compound with molecular formula C21H20BrN3O5S and molecular weight 505.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-2-oxochromene-3-carboxamide
Also Known As: 6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide, 6-bromo-N-{4-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}-2-oxo-2H-chromene-3-carboxamide, F1452-0256, 6-bromo-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-2-oxochromene-3-carboxamide, (6-bromo-2-oxochromen-3-yl)-N-{4-[(4-methylpiperazinyl)sulfonyl]phenyl}carboxa mide
| Molecular Formula | C21H20BrN3O5S |
|---|---|
| Molecular Weight | 505.03 g/mol |
| LogP | 2.7439 |
| Topological Polar Surface Area | 99.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 505.0307 |
| Heavy Atoms | 31 |
| Complexity | 1296.835 |
Chemical Identifiers
| CAS Number | 694501-55-8 |
|---|---|
| SMILES | CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=CC(=C4)Br)OC3=O |
Product Overview
6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide (CAS 694501-55-8), with molecular formula C21H20BrN3O5S and molecular weight 505.03 g/mol. IUPAC: 6-bromo-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-2-oxochromene-3-carboxamide.
Chemical Property Profile of 6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide
Property Insights of 6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide
The XLogP value of 2.7439 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide. The TPSA of 99.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide. Following Lipinski's Rule of Five, 6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide has 1 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 6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide?
The CAS number of 6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide is 694501-55-8.
What is the molecular formula of 6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide?
The molecular formula of 6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide is C21H20BrN3O5S.
What is the molecular weight of 6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide?
The molecular weight of 6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide is 505.03 g/mol.
Where can I buy 6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide?
You can request a quote for 6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 6-bromo-N-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-2-oxo-2H-chromene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.