4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole
TL;DR: 4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole (CAS 1027326-78-8) is a chemical compound with molecular formula C11H11N5O5 and molecular weight 293.07602 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-methoxy-5-nitrophenyl)-5-methyl-4-nitro-1H-pyrazol-3-amine
Also Known As: 4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole, N-(2-methoxy-5-nitrophenyl)-5-methyl-4-nitro-1H-pyrazol-3-amine
Technical Specifications
| Molecular Formula | C11H11N5O5 |
| Molecular Weight | 293.07602 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 142.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.07602 Da |
| Heavy Atoms | 21 |
| Complexity | 397.0 |
| SMILES | CC1=C(C(=NN1)NC2=C(C=CC(=C2)[N+](=O)[O-])OC)[N+](=O)[O-] |
| InChIKey | AUYMONXSTAARLU-UHFFFAOYSA-N |
Chemical Property Profile of 4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole
Property Insights of 4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole. The TPSA of 142.0 Ų indicates high polarity, suggesting 4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole?
The CAS number of 4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole is 1027326-78-8.
What is the molecular formula of 4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole?
The molecular formula of 4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole is C11H11N5O5.
What is the molecular weight of 4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole?
The molecular weight of 4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole is 293.07602 g/mol.
Where can I buy 4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole?
You can request a quote for 4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole?
Yes, CoreyChem provides custom synthesis services for 4-nitro-5-{5-nitro-2-methoxyanilino}-3-methyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.