6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide
TL;DR: 6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide (CAS 684227-53-0) is a chemical compound with molecular formula C12H10BrNO3 and molecular weight 294.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide
Also Known As: 6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide, 6-bromo-N,N-dimethyl-2-oxo-2H-chromene-3-carboxamide, N,N-dimethyl-6-bromo-3-coumarincarboxamide, F1132-0780, (6-bromo-2-oxochromen-3-yl)-N,N-dimethylcarboxamide
| Molecular Formula | C12H10BrNO3 |
|---|---|
| Molecular Weight | 294.98 g/mol |
| LogP | 2.2573 |
| Topological Polar Surface Area | 50.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 294.9844 |
| Heavy Atoms | 17 |
| Complexity | 645.7311 |
Chemical Identifiers
| CAS Number | 684227-53-0 |
|---|---|
| SMILES | CN(C)C(=O)C1=CC2=C(C=CC(=C2)Br)OC1=O |
Product Overview
6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide (CAS 684227-53-0), with molecular formula C12H10BrNO3 and molecular weight 294.98 g/mol. IUPAC: 6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide.
Chemical Property Profile of 6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide
Property Insights of 6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide
The XLogP value of 2.2573 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide. With a topological polar surface area (TPSA) of 50.52 Ų, 6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide?
The CAS number of 6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide is 684227-53-0.
What is the molecular formula of 6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide?
The molecular formula of 6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide is C12H10BrNO3.
What is the molecular weight of 6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide?
The molecular weight of 6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide is 294.98 g/mol.
Where can I buy 6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide?
You can request a quote for 6-bromo-N,N-dimethyl-2-oxochromene-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,N-dimethyl-2-oxochromene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 6-bromo-N,N-dimethyl-2-oxochromene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.