4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine
TL;DR: 4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine (CAS 300587-61-5) is a chemical compound with molecular formula C10H14N4O3 and molecular weight 238.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-2-(1-methyl-4-nitropyrazol-5-yl)ethenyl]morpholine
Also Known As: BIM-0020080.P001, 4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine, (E)-4-(2-(1-methyl-4-nitro-1H-pyrazol-5-yl)vinyl)morpholine, 4-[(1E)-2-(1-methyl-4-nitropyrazol-5-yl)vinyl]morpholine, 4-[(E)-2-(1-methyl-4-nitro-1H-pyrazol-5-yl)ethenyl]morpholine
| Molecular Formula | C10H14N4O3 |
|---|---|
| Molecular Weight | 238.11 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 76.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 238.1066 |
| Heavy Atoms | 17 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 300587-61-5 |
|---|---|
| SMILES | CN1C(=C(C=N1)[N+](=O)[O-])/C=C/N2CCOCC2 |
| InChIKey | KDURESZCUMGJOR-NSCUHMNNSA-N |
Product Overview
4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine (CAS 300587-61-5), with molecular formula C10H14N4O3 and molecular weight 238.11 g/mol. IUPAC: 4-[(E)-2-(1-methyl-4-nitropyrazol-5-yl)ethenyl]morpholine.
Chemical Property Profile of 4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine
Property Insights of 4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine. The TPSA of 76.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine. Following Lipinski's Rule of Five, 4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine has 0 hydrogen bond donor(s) and 5 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 4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine?
The CAS number of 4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine is 300587-61-5.
What is the molecular formula of 4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine?
The molecular formula of 4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine is C10H14N4O3.
What is the molecular weight of 4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine?
The molecular weight of 4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine is 238.11 g/mol.
Where can I buy 4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine?
You can request a quote for 4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine?
Yes, KEHONG BIO provides custom synthesis services for 4-[(E)-2-(2-methyl-4-nitropyrazol-3-yl)ethenyl]morpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.