![3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide structure](/static/products/749/749918-36-3.png)
3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide
TL;DR: 3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide (CAS 749918-36-3) is a chemical compound with molecular formula C21H21ClN4O6S and molecular weight 492.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-5-nitro-N-[2-oxo-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethyl]benzamide
Also Known As: 3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide, 3-chloro-5-nitro-N-{2-oxo-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethyl}benzamide, 3-chloro-5-nitro-N-[2-oxo-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethyl]benzamide
| Molecular Formula | C21H21ClN4O6S |
|---|---|
| Molecular Weight | 492.09 g/mol |
| LogP | 2.1229 |
| Topological Polar Surface Area | 129.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 492.08704 |
| Heavy Atoms | 33 |
| Complexity | 1178.496 |
Chemical Identifiers
| CAS Number | 749918-36-3 |
|---|---|
| SMILES | C1CN(CCN1C(=O)CNC(=O)C2=CC(=CC(=C2)Cl)[N+](=O)[O-])S(=O)(=O)/C=C/C3=CC=CC=C3 |
Product Overview
3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide (CAS 749918-36-3), with molecular formula C21H21ClN4O6S and molecular weight 492.09 g/mol. IUPAC: 3-chloro-5-nitro-N-[2-oxo-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethyl]benzamide.
Chemical Property Profile of 3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide
Property Insights of 3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide
The XLogP value of 2.1229 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide. The TPSA of 129.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide. Following Lipinski's Rule of Five, 3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide has 1 hydrogen bond donor(s) and 6 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 3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide?
The CAS number of 3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide is 749918-36-3.
What is the molecular formula of 3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide?
The molecular formula of 3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide is C21H21ClN4O6S.
What is the molecular weight of 3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide?
The molecular weight of 3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide is 492.09 g/mol.
Where can I buy 3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide?
You can request a quote for 3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-5-nitro-N-[2-oxo-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.