![2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine structure](/static/products/866/866153-27-7.png)
2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine
TL;DR: 2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine (CAS 866153-27-7) is a chemical compound with molecular formula C14H14ClN5O4S and molecular weight 383.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(4-chloro-2-nitrophenyl)sulfonylpiperazin-1-yl]pyrimidine
Also Known As: 2-{4-[(4-chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine, 2-[4-(4-chloro-2-nitrobenzenesulfonyl)piperazin-1-yl]pyrimidine, 2-[4-(4-chloro-2-nitrophenyl)sulfonylpiperazin-1-yl]pyrimidine
| Molecular Formula | C14H14ClN5O4S |
|---|---|
| Molecular Weight | 383.05 g/mol |
| LogP | 1.5491 |
| Topological Polar Surface Area | 109.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.0455 |
| Heavy Atoms | 25 |
| Complexity | 885.35004 |
Chemical Identifiers
| CAS Number | 866153-27-7 |
|---|---|
| SMILES | C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-] |
Product Overview
2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine (CAS 866153-27-7), with molecular formula C14H14ClN5O4S and molecular weight 383.05 g/mol. IUPAC: 2-[4-(4-chloro-2-nitrophenyl)sulfonylpiperazin-1-yl]pyrimidine.
Chemical Property Profile of 2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine
Property Insights of 2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine
The XLogP value of 1.5491 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine. The TPSA of 109.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine. Following Lipinski's Rule of Five, 2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine has 0 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 2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine?
The CAS number of 2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine is 866153-27-7.
What is the molecular formula of 2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine?
The molecular formula of 2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine is C14H14ClN5O4S.
What is the molecular weight of 2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine?
The molecular weight of 2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine is 383.05 g/mol.
Where can I buy 2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine?
You can request a quote for 2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-{4-[(4-Chloro-2-nitrophenyl)sulfonyl]piperazino}pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.