Sch 59228
TL;DR: Sch 59228 (CAS 183482-17-9) is a chemical compound with molecular formula C25H24BrClN4O2 and molecular weight 526.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(6-bromo-13-chloro-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]-2-(1-oxidopyridin-1-ium-4-yl)ethanone
Also Known As: Sch 59228, Piperazine, 1-(3-bromo-8-chloro-6,11-dihydro-5H-benzo(5,6)cyclohepta(1,2-b)pyridin-11-yl)-4-((1-oxido-4-pyridinyl)acetyl)-, 1-[4-(6-Bromo-13-chloro-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]-2-(1-oxidopyridin-1-ium-4-yl)ethanone, 1-[4-(3-Bromo-8-chloro-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-yl)-piperazin-1-yl]-2-(1-oxy-pyridin-4-yl)-ethanone, 4-[2-(4-{6-bromo-13-chloro-4-azatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-2-yl}piperazin-1-yl)-2-oxoethyl]pyridin-1-ium-1-olate
| Molecular Formula | C25H24BrClN4O2 |
|---|---|
| Molecular Weight | 526.08 g/mol |
| LogP | 3.7058 |
| Topological Polar Surface Area | 63.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 526.07715 |
| Heavy Atoms | 33 |
| Complexity | 1126.0245 |
Chemical Identifiers
| CAS Number | 183482-17-9 |
|---|---|
| SMILES | C1CC2=C(C(C3=C1C=C(C=C3)Cl)N4CCN(CC4)C(=O)CC5=CC=[N+](C=C5)[O-])N=CC(=C2)Br |
Product Overview
Sch 59228 (CAS 183482-17-9), with molecular formula C25H24BrClN4O2 and molecular weight 526.08 g/mol. IUPAC: 1-[4-(6-bromo-13-chloro-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]-2-(1-oxidopyridin-1-ium-4-yl)ethanone.
Chemical Property Profile of Sch 59228
Property Insights of Sch 59228
The XLogP value of 3.7058 indicates that Sch 59228 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.38 Ų falls within the moderate polarity range, balancing permeability and solubility for Sch 59228. Following Lipinski's Rule of Five, Sch 59228 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Sch 59228?
The CAS number of Sch 59228 is 183482-17-9.
What is the molecular formula of Sch 59228?
The molecular formula of Sch 59228 is C25H24BrClN4O2.
What is the molecular weight of Sch 59228?
The molecular weight of Sch 59228 is 526.08 g/mol.
Where can I buy Sch 59228?
You can request a quote for Sch 59228 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sch 59228?
Yes, KEHONG BIO provides custom synthesis services for Sch 59228 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.