methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate
TL;DR: methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate (CAS 672899-28-4) is a chemical compound with molecular formula C15H23BrN2O3 and molecular weight 358.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-bromo-1-[2-[di(propan-2-yl)amino]ethyl]-6-oxopyridine-3-carboxylate
Also Known As: methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate, methyl 5-bromo-1-[2-(dipropan-2-ylamino)ethyl]-6-oxo-1,6-dihydropyridine-3-carboxylate, methyl 5-bromo-1-[2-[di(propan-2-yl)amino]ethyl]-6-oxopyridine-3-carboxylate
| Molecular Formula | C15H23BrN2O3 |
|---|---|
| Molecular Weight | 358.09 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 49.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 358.0892 |
| Heavy Atoms | 21 |
| Complexity | 462.0 |
Chemical Identifiers
| CAS Number | 672899-28-4 |
|---|---|
| SMILES | CC(C)N(CCN1C=C(C=C(C1=O)Br)C(=O)OC)C(C)C |
| InChIKey | AISWMQDPEPWOTN-UHFFFAOYSA-N |
Product Overview
methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate (CAS 672899-28-4), with molecular formula C15H23BrN2O3 and molecular weight 358.09 g/mol. IUPAC: methyl 5-bromo-1-[2-[di(propan-2-yl)amino]ethyl]-6-oxopyridine-3-carboxylate.
Chemical Property Profile of methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate
Property Insights of methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate. With a topological polar surface area (TPSA) of 49.9 Ų, methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate has 0 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 methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate?
The CAS number of methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate is 672899-28-4.
What is the molecular formula of methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate?
The molecular formula of methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate is C15H23BrN2O3.
What is the molecular weight of methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate?
The molecular weight of methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate is 358.09 g/mol.
Where can I buy methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate?
You can request a quote for methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-bromo-1-(2-(diisopropylamino)ethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.