6-bromo-2-oxo-2H-chromene-3-carbothioamide
TL;DR: 6-bromo-2-oxo-2H-chromene-3-carbothioamide (CAS 69015-71-0) is a chemical compound with molecular formula C10H6BrNO2S and molecular weight 282.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-2-oxochromene-3-carbothioamide
Also Known As: 6-bromo-2-oxochromene-3-carbothioamide, 6-bromo-2-oxo-2H-chromene-3-carbothioamide, 6-bromo-2-keto-chromene-3-carbothioamide, 6-bromo-2-oxo-1-benzopyran-3-carbothioamide, 6-Bromo-2-oxo-2H-chromene-3-carbothioic acid amide
| Molecular Formula | C10H6BrNO2S |
|---|---|
| Molecular Weight | 282.93 g/mol |
| LogP | 2.1897 |
| Topological Polar Surface Area | 56.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 282.93027 |
| Heavy Atoms | 15 |
| Complexity | 605.88416 |
Chemical Identifiers
| CAS Number | 69015-71-0 |
|---|---|
| SMILES | C1=CC2=C(C=C1Br)C=C(C(=O)O2)C(=S)N |
Product Overview
6-bromo-2-oxo-2H-chromene-3-carbothioamide (CAS 69015-71-0), with molecular formula C10H6BrNO2S and molecular weight 282.93 g/mol. IUPAC: 6-bromo-2-oxochromene-3-carbothioamide.
Chemical Property Profile of 6-bromo-2-oxo-2H-chromene-3-carbothioamide
Property Insights of 6-bromo-2-oxo-2H-chromene-3-carbothioamide
The XLogP value of 2.1897 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-bromo-2-oxo-2H-chromene-3-carbothioamide. With a topological polar surface area (TPSA) of 56.23 Ų, 6-bromo-2-oxo-2H-chromene-3-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-bromo-2-oxo-2H-chromene-3-carbothioamide has 1 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-2-oxo-2H-chromene-3-carbothioamide?
The CAS number of 6-bromo-2-oxo-2H-chromene-3-carbothioamide is 69015-71-0.
What is the molecular formula of 6-bromo-2-oxo-2H-chromene-3-carbothioamide?
The molecular formula of 6-bromo-2-oxo-2H-chromene-3-carbothioamide is C10H6BrNO2S.
What is the molecular weight of 6-bromo-2-oxo-2H-chromene-3-carbothioamide?
The molecular weight of 6-bromo-2-oxo-2H-chromene-3-carbothioamide is 282.93 g/mol.
Where can I buy 6-bromo-2-oxo-2H-chromene-3-carbothioamide?
You can request a quote for 6-bromo-2-oxo-2H-chromene-3-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-bromo-2-oxo-2H-chromene-3-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 6-bromo-2-oxo-2H-chromene-3-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.