Metaraminol Impurity 19
TL;DR: Metaraminol Impurity 19 (CAS 339311-01-2) is a chemical compound with molecular formula C17H12BrN3O5 and molecular weight 417.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyl-1-(5-bromo-2-pyridinyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one
Also Known As: Metaraminol Impurity 19, 4-acetyl-1-(5-bromopyridin-2-yl)-3-hydroxy-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one, 3-acetyl-1-(5-bromopyridin-2-yl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one, Benzyl alcohol, .alpha.-(1-aminoethyl)-3,4-dihydroxy-, hydrochloride, ()-, 1,2-Benzenediol, 4-(2-amino-1-hydroxypropyl)-, hydrochloride, [S-(R*,R*)]-
| Molecular Formula | C17H12BrN3O5 |
|---|---|
| Molecular Weight | 417.00 g/mol |
| LogP | 3.2413 |
| Topological Polar Surface Area | 113.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 416.99603 |
| Heavy Atoms | 26 |
| Complexity | 937.8756 |
Chemical Identifiers
| CAS Number | 339311-01-2 |
|---|---|
| SMILES | CC(=O)C1=C(C(=O)N(C1C2=CC=C(C=C2)[N+](=O)[O-])C3=NC=C(C=C3)Br)O |
Product Overview
Metaraminol Impurity 19 (CAS 339311-01-2), with molecular formula C17H12BrN3O5 and molecular weight 417.00 g/mol. IUPAC: 3-acetyl-1-(5-bromo-2-pyridinyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one.
Chemical Property Profile of Metaraminol Impurity 19
Property Insights of Metaraminol Impurity 19
The XLogP value of 3.2413 indicates that Metaraminol Impurity 19 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.64 Ų falls within the moderate polarity range, balancing permeability and solubility for Metaraminol Impurity 19. Following Lipinski's Rule of Five, Metaraminol Impurity 19 has 1 hydrogen bond donor(s) and 6 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 Metaraminol Impurity 19?
The CAS number of Metaraminol Impurity 19 is 339311-01-2.
What is the molecular formula of Metaraminol Impurity 19?
The molecular formula of Metaraminol Impurity 19 is C17H12BrN3O5.
What is the molecular weight of Metaraminol Impurity 19?
The molecular weight of Metaraminol Impurity 19 is 417.00 g/mol.
Where can I buy Metaraminol Impurity 19?
You can request a quote for Metaraminol Impurity 19 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Metaraminol Impurity 19?
Yes, KEHONG BIO provides custom synthesis services for Metaraminol Impurity 19 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.