Brn 4605228
TL;DR: Brn 4605228 (CAS 76298-68-5) is a chemical compound with molecular formula C25H23N3O3S and molecular weight 445.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3S,3aR)-5-(4-methylphenyl)sulfonyl-3-phenyl-3a,4-dihydro-3H-pyrazolo[4,3-c]quinolin-2-yl]ethanone
Also Known As: cis-2-Acetyl-3-phenyl-5-tosyl-3,3a,4,5-tetrahydropyrazolo(4,3-c)quinoline, 2H-Pyrazolo(4,3-c)quinoline, 3,3a,4,5-tetrahydro-2-acetyl-5-((4-methylphenyl)sulfonyl)-3-phenyl-, cis-, 1-[(3S,3aR)-5-(4-methylphenyl)sulfonyl-3-phenyl-3a,4-dihydro, 1-[(3S,3aR)-5-(4-methylphenyl)sulfonyl-3-phenyl-3a,4-dihydro-3H-pyrazolo[4,3-c]quinolin-2-yl]ethanone, 2-Acetyl-3-phenyl-5-tosyl-3,3a,4,5-tetrahydropyrazolo(4,3-c)quinoline, cis-
| Molecular Formula | C25H23N3O3S |
|---|---|
| Molecular Weight | 445.15 g/mol |
| LogP | 4.12762 |
| Topological Polar Surface Area | 70.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 445.14603 |
| Heavy Atoms | 32 |
| Complexity | 1318.0529 |
Chemical Identifiers
| CAS Number | 76298-68-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2C[C@@H]3[C@H](N(N=C3C4=CC=CC=C42)C(=O)C)C5=CC=CC=C5 |
Product Overview
Brn 4605228 (CAS 76298-68-5), with molecular formula C25H23N3O3S and molecular weight 445.15 g/mol. IUPAC: 1-[(3S,3aR)-5-(4-methylphenyl)sulfonyl-3-phenyl-3a,4-dihydro-3H-pyrazolo[4,3-c]quinolin-2-yl]ethanone.
Chemical Property Profile of Brn 4605228
Property Insights of Brn 4605228
The XLogP value of 4.12762 indicates that Brn 4605228 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.05 Ų falls within the moderate polarity range, balancing permeability and solubility for Brn 4605228. Following Lipinski's Rule of Five, Brn 4605228 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 Brn 4605228?
The CAS number of Brn 4605228 is 76298-68-5.
What is the molecular formula of Brn 4605228?
The molecular formula of Brn 4605228 is C25H23N3O3S.
What is the molecular weight of Brn 4605228?
The molecular weight of Brn 4605228 is 445.15 g/mol.
Where can I buy Brn 4605228?
You can request a quote for Brn 4605228 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Brn 4605228?
Yes, KEHONG BIO provides custom synthesis services for Brn 4605228 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.