硝基格鲁米特
TL;DR: 硝基格鲁米特 (CAS 54714-92-0) is a chemical compound with molecular formula C13H14N2O4 and molecular weight 262.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硝基格鲁米特
3-ethyl-3-(4-nitrophenyl)piperidine-2,6-dione
Also Known As: Nitroglutethimide, p-Nitroglutethimide, 3-Ethyl-3-(4-nitrophenyl)piperidine-2,6-dione, 4-NITROGLUTETHIMIDE, 2-(p-Nitrophenyl)-2-ethylglutarimide
| Molecular Formula | C13H14N2O4 |
|---|---|
| Molecular Weight | 262.10 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 92.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.09537 |
| Heavy Atoms | 19 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 54714-92-0 |
|---|---|
| SMILES | CCC1(CCC(=O)NC1=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | ZHPKYOHYUWTINN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
硝基格鲁米特 (CAS 54714-92-0), with molecular formula C13H14N2O4 and molecular weight 262.10 g/mol. IUPAC: 3-ethyl-3-(4-nitrophenyl)piperidine-2,6-dione.
Chemical Property Profile of 硝基格鲁米特
Property Insights of 硝基格鲁米特
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 硝基格鲁米特. The TPSA of 92.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 硝基格鲁米特. Following Lipinski's Rule of Five, 硝基格鲁米特 has 1 hydrogen bond donor(s) and 4 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 硝基格鲁米特?
The CAS number of 硝基格鲁米特 is 54714-92-0.
What is the molecular formula of 硝基格鲁米特?
The molecular formula of 硝基格鲁米特 is C13H14N2O4.
What is the molecular weight of 硝基格鲁米特?
The molecular weight of 硝基格鲁米特 is 262.10 g/mol.
Where can I buy 硝基格鲁米特?
You can request a quote for 硝基格鲁米特 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硝基格鲁米特?
Yes, KEHONG BIO provides custom synthesis services for 硝基格鲁米特 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.