A2642/0112526
TL;DR: A2642/0112526 (CAS 380333-87-9) is a chemical compound with molecular formula C29H28ClN3O3 and molecular weight 501.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]-1-(4-phenylpiperazin-1-yl)ethanone
Also Known As: A2642/0112526, 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]-1-(4-phenylpiperazin-1-yl)ethanone, 2-[1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1h-indol-3-yl]-1-(4-phenyl-1-piperazinyl)ethanone, 2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methylindol-3-yl}-1-(4-phenylpiper azinyl)ethan-1-one
| Molecular Formula | C29H28ClN3O3 |
|---|---|
| Molecular Weight | 501.18 g/mol |
| LogP | 5.19152 |
| Topological Polar Surface Area | 54.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 501.18192 |
| Heavy Atoms | 36 |
| Complexity | 1405.486 |
Chemical Identifiers
| CAS Number | 380333-87-9 |
|---|---|
| SMILES | CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)N4CCN(CC4)C5=CC=CC=C5 |
Product Overview
A2642/0112526 (CAS 380333-87-9), with molecular formula C29H28ClN3O3 and molecular weight 501.18 g/mol. IUPAC: 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]-1-(4-phenylpiperazin-1-yl)ethanone.
Chemical Property Profile of A2642/0112526
Property Insights of A2642/0112526
The XLogP value of 5.19152 indicates that A2642/0112526 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.78 Ų, A2642/0112526 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A2642/0112526 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 A2642/0112526?
The CAS number of A2642/0112526 is 380333-87-9.
What is the molecular formula of A2642/0112526?
The molecular formula of A2642/0112526 is C29H28ClN3O3.
What is the molecular weight of A2642/0112526?
The molecular weight of A2642/0112526 is 501.18 g/mol.
Where can I buy A2642/0112526?
You can request a quote for A2642/0112526 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2642/0112526?
Yes, KEHONG BIO provides custom synthesis services for A2642/0112526 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.