(4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone
TL;DR: (4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone (CAS 443289-32-5) is a chemical compound with molecular formula C21H21N5O3S and molecular weight 423.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]-thiophen-2-ylmethanone
Also Known As: (4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone, (4-{4-nitro-3-[(pyridin-3-ylmethyl)amino]phenyl}piperazin-1-yl)(thiophen-2-yl)methanone, [4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]-thiophen-2-yl-methanone, [4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]-thiophen-2-ylmethanone
| Molecular Formula | C21H21N5O3S |
|---|---|
| Molecular Weight | 423.14 g/mol |
| LogP | 3.6258 |
| Topological Polar Surface Area | 91.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 423.1365 |
| Heavy Atoms | 30 |
| Complexity | 1018.3858 |
Chemical Identifiers
| CAS Number | 443289-32-5 |
|---|---|
| SMILES | C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CN=CC=C3)C(=O)C4=CC=CS4 |
Product Overview
(4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone (CAS 443289-32-5), with molecular formula C21H21N5O3S and molecular weight 423.14 g/mol. IUPAC: [4-[4-nitro-3-(pyridin-3-ylmethylamino)phenyl]piperazin-1-yl]-thiophen-2-ylmethanone.
Chemical Property Profile of (4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone
Property Insights of (4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone
The XLogP value of 3.6258 indicates that (4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.61 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone. Following Lipinski's Rule of Five, (4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone has 1 hydrogen bond donor(s) and 7 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 (4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone?
The CAS number of (4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone is 443289-32-5.
What is the molecular formula of (4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone?
The molecular formula of (4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone is C21H21N5O3S.
What is the molecular weight of (4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone?
The molecular weight of (4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone is 423.14 g/mol.
Where can I buy (4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone?
You can request a quote for (4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-(4-nitro-3-((pyridin-3-ylmethyl)amino)phenyl)piperazin-1-yl)(thiophen-2-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.