Methyl 2-(1-(4-nitrobenzoyl)-3-oxopiperazin-2-yl)acetate
TL;DR: Methyl 2-(1-(4-nitrobenzoyl)-3-oxopiperazin-2-yl)acetate (CAS 474263-09-7) is a chemical compound with molecular formula C14H15N3O6 and molecular weight 321.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[1-(4-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate
Also Known As: UPCMLD0ENAT5967548:001, methyl 2-(1-(4-nitrobenzoyl)-3-oxopiperazin-2-yl)acetate, methyl 2-[1-(4-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate, F1128-0008, methyl [1-(4-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate
| Molecular Formula | C14H15N3O6 |
|---|---|
| Molecular Weight | 321.10 g/mol |
| LogP | 0.0985 |
| Topological Polar Surface Area | 118.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.0961 |
| Heavy Atoms | 23 |
| Complexity | 642.4176 |
Chemical Identifiers
| CAS Number | 474263-09-7 |
|---|---|
| SMILES | COC(=O)CC1C(=O)NCCN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
Methyl 2-(1-(4-nitrobenzoyl)-3-oxopiperazin-2-yl)acetate (CAS 474263-09-7), with molecular formula C14H15N3O6 and molecular weight 321.10 g/mol. IUPAC: methyl 2-[1-(4-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate.
Chemical Property Profile of Methyl 2-(1-(4-nitrobenzoyl)-3-oxopiperazin-2-yl)acetate
Property Insights of Methyl 2-(1-(4-nitrobenzoyl)-3-oxopiperazin-2-yl)acetate
The XLogP value of 0.0985 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(1-(4-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-(4-nitrobenzoyl)-3-oxopiperazin-2-yl)acetate. Following Lipinski's Rule of Five, Methyl 2-(1-(4-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-(4-nitrobenzoyl)-3-oxopiperazin-2-yl)acetate?
The CAS number of Methyl 2-(1-(4-nitrobenzoyl)-3-oxopiperazin-2-yl)acetate is 474263-09-7.
What is the molecular formula of Methyl 2-(1-(4-nitrobenzoyl)-3-oxopiperazin-2-yl)acetate?
The molecular formula of Methyl 2-(1-(4-nitrobenzoyl)-3-oxopiperazin-2-yl)acetate is C14H15N3O6.
What is the molecular weight of Methyl 2-(1-(4-nitrobenzoyl)-3-oxopiperazin-2-yl)acetate?
The molecular weight of Methyl 2-(1-(4-nitrobenzoyl)-3-oxopiperazin-2-yl)acetate is 321.10 g/mol.
Where can I buy Methyl 2-(1-(4-nitrobenzoyl)-3-oxopiperazin-2-yl)acetate?
You can request a quote for Methyl 2-(1-(4-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-(4-nitrobenzoyl)-3-oxopiperazin-2-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(1-(4-nitrobenzoyl)-3-oxopiperazin-2-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.