3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one
TL;DR: 3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one (CAS 51446-77-6) is a chemical compound with molecular formula C10H8Br2N2O2 and molecular weight 345.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one
Also Known As: Dibromoticonine, 3,4-dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one, 3,4-dibromo-5-hydroxy-1-methyl-5-(pyridin-3-yl)-1,5-dihydro-2h-pyrrol-2-one, 2H-Pyrrol-2-one,3,4-dibromo-1,5-dihydro-5-hydroxy-1-methyl-5-(3-pyridinyl)-, 3,4-dibromo-5-hydroxy-1-methyl-5-pyridin-3-yl-1,5-dihydro-pyrrol-2-one
| Molecular Formula | C10H8Br2N2O2 |
|---|---|
| Molecular Weight | 345.90 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 53.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 345.89526 |
| Heavy Atoms | 16 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 51446-77-6 |
|---|---|
| SMILES | CN1C(=O)C(=C(C1(C2=CN=CC=C2)O)Br)Br |
| InChIKey | KTXPVEPIXXSNIM-UHFFFAOYSA-N |
Product Overview
3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one (CAS 51446-77-6), with molecular formula C10H8Br2N2O2 and molecular weight 345.90 g/mol. IUPAC: 3,4-dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one.
Chemical Property Profile of 3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one
Property Insights of 3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one. With a topological polar surface area (TPSA) of 53.4 Ų, 3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one 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 3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one?
The CAS number of 3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one is 51446-77-6.
What is the molecular formula of 3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one?
The molecular formula of 3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one is C10H8Br2N2O2.
What is the molecular weight of 3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one?
The molecular weight of 3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one is 345.90 g/mol.
Where can I buy 3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one?
You can request a quote for 3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dibromo-5-hydroxy-1-methyl-5-pyridin-3-ylpyrrol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.