2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone
TL;DR: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone (CAS 353455-57-9) is a chemical compound with molecular formula C15H15BrN4O3 and molecular weight 378.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone
Also Known As: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone, 1-[(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)acetyl]-1,2,3,4-tetrahydroquinoline, 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-1-(3,4-dihydroquinolin-1(2H)-yl)ethanone, 1-({4-bromo-3-nitro-5-methyl-1H-pyrazol-1-yl}acetyl)-1,2,3,4-tetrahydroquinoline, 2-(4-BROMO-5-METHYL-3-NITRO-1H-PYRAZOL-1-YL)-1-(1,2,3,4-TETRAHYDROQUINOLIN-1-YL)ETHAN-1-ONE
| Molecular Formula | C15H15BrN4O3 |
|---|---|
| Molecular Weight | 378.03 g/mol |
| LogP | 2.84162 |
| Topological Polar Surface Area | 81.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 378.03275 |
| Heavy Atoms | 23 |
| Complexity | 787.02435 |
Chemical Identifiers
| CAS Number | 353455-57-9 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=O)N2CCCC3=CC=CC=C32)[N+](=O)[O-])Br |
Product Overview
2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone (CAS 353455-57-9), with molecular formula C15H15BrN4O3 and molecular weight 378.03 g/mol. IUPAC: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone.
Chemical Property Profile of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone
Property Insights of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone
The XLogP value of 2.84162 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone. The TPSA of 81.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone. Following Lipinski's Rule of Five, 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone 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 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone?
The CAS number of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone is 353455-57-9.
What is the molecular formula of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone?
The molecular formula of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone is C15H15BrN4O3.
What is the molecular weight of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone?
The molecular weight of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone is 378.03 g/mol.
Where can I buy 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone?
You can request a quote for 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.