![Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate structure](/static/products/1008/1008016-23-6.webp)
Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate
TL;DR: Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate (CAS 1008016-23-6) is a chemical compound with molecular formula C14H14ClN3O6 and molecular weight 355.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate
Also Known As: methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate, methyl {1-[(2-chloro-5-nitrophenyl)carbonyl]-3-oxopiperazin-2-yl}acetate, Methyl [1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate, methyl 2-(1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl)acetate, methyl 2-{1-[(2-chloro-5-nitrophenyl)carbonyl]-3-oxopiperazin-2-yl}acetate
| Molecular Formula | C14H14ClN3O6 |
|---|---|
| Molecular Weight | 355.06 g/mol |
| LogP | 0.7519 |
| Topological Polar Surface Area | 118.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 355.0571 |
| Heavy Atoms | 24 |
| Complexity | 707.75024 |
Chemical Identifiers
| CAS Number | 1008016-23-6 |
|---|---|
| SMILES | COC(=O)CC1C(=O)NCCN1C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl |
Product Overview
Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate (CAS 1008016-23-6), with molecular formula C14H14ClN3O6 and molecular weight 355.06 g/mol. IUPAC: methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate.
Chemical Property Profile of Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate
Property Insights of Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate
The XLogP value of 0.7519 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate. The TPSA of 118.85 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate. Following Lipinski's Rule of Five, Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate 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 Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate?
The CAS number of Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate is 1008016-23-6.
What is the molecular formula of Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate?
The molecular formula of Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate is C14H14ClN3O6.
What is the molecular weight of Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate?
The molecular weight of Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate is 355.06 g/mol.
Where can I buy Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate?
You can request a quote for Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[1-(2-chloro-5-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.