![5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide structure](/static/products/672/672902-85-1.png)
5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide
TL;DR: 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide (CAS 672902-85-1) is a chemical compound with molecular formula C10H13BrN2O3 and molecular weight 288.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide
Also Known As: 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide, 3-bromo-N-[2-(dimethylamino)ethyl]-2-oxo-2H-pyran-5-carboxamide, 5-bromo-N-(2-dimethylaminoethyl)-6-oxopyran-3-carboxamide, 5-bromo-N-[2-(dimethylamino)ethyl]-6-keto-pyran-3-carboxamide, 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxo-3-pyrancarboxamide
| Molecular Formula | C10H13BrN2O3 |
|---|---|
| Molecular Weight | 288.01 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.01096 |
| Heavy Atoms | 16 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 672902-85-1 |
|---|---|
| SMILES | CN(C)CCNC(=O)C1=COC(=O)C(=C1)Br |
| InChIKey | QWECBWLQUCGEJG-UHFFFAOYSA-N |
Product Overview
5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide (CAS 672902-85-1), with molecular formula C10H13BrN2O3 and molecular weight 288.01 g/mol. IUPAC: 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide.
Chemical Property Profile of 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide
Property Insights of 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide. With a topological polar surface area (TPSA) of 58.6 Ų, 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide has 1 hydrogen bond donor(s) and 4 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 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide?
The CAS number of 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide is 672902-85-1.
What is the molecular formula of 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide?
The molecular formula of 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide is C10H13BrN2O3.
What is the molecular weight of 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide?
The molecular weight of 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide is 288.01 g/mol.
Where can I buy 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide?
You can request a quote for 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-N-[2-(dimethylamino)ethyl]-6-oxopyran-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.