![(2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone structure](/static/products/3473/347355-39-9.webp)
(2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone
TL;DR: (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone (CAS 347355-39-9) is a chemical compound with molecular formula C27H27ClF2N4O5 and molecular weight 560.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone
Also Known As: (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone, (2-chloro-4,5-difluorophenyl)(4-(3-((3,4-dimethoxyphenethyl)amino)-4-nitrophenyl)piperazin-1-yl)methanone, (2-chloro-4,5-difluorophenyl)[4-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-nitrophenyl)piperazin-1-yl]methanone, 4-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-nitrophenyl)piperazinyl 2-chloro- 4,5-difluorophenyl ketone
| Molecular Formula | C27H27ClF2N4O5 |
|---|---|
| Molecular Weight | 560.16 g/mol |
| LogP | 5.1606 |
| Topological Polar Surface Area | 97.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 560.1638 |
| Heavy Atoms | 39 |
| Complexity | 1382.5237 |
Chemical Identifiers
| CAS Number | 347355-39-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNC2=C(C=CC(=C2)N3CCN(CC3)C(=O)C4=CC(=C(C=C4Cl)F)F)[N+](=O)[O-])OC |
Product Overview
(2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone (CAS 347355-39-9), with molecular formula C27H27ClF2N4O5 and molecular weight 560.16 g/mol. IUPAC: (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone.
Chemical Property Profile of (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone
Property Insights of (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone
The XLogP value of 5.1606 indicates that (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.18 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone. Following Lipinski's Rule of Five, (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone?
The CAS number of (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone is 347355-39-9.
What is the molecular formula of (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone?
The molecular formula of (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone is C27H27ClF2N4O5.
What is the molecular weight of (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone?
The molecular weight of (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone is 560.16 g/mol.
Where can I buy (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone?
You can request a quote for (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone?
Yes, KEHONG BIO provides custom synthesis services for (2-chloro-4,5-difluorophenyl)-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.