N-butyl-4-nitro-1H-pyrazole-5-carboxamide
TL;DR: N-butyl-4-nitro-1H-pyrazole-5-carboxamide (CAS 360573-39-3) is a chemical compound with molecular formula C8H12N4O3 and molecular weight 212.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-4-nitro-1H-pyrazole-5-carboxamide
Also Known As: N-butyl-4-nitro-1H-pyrazole-5-carboxamide, ZERO/006215, N-BUTYL-4-NITRO-1H-PYRAZOLE-3-CARBOXAMIDE, N-butyl(4-nitropyrazol-5-yl)carboxamide, {N}-butyl-4-nitro-1{H}-pyrazole-5-carboxamide
| Molecular Formula | C8H12N4O3 |
|---|---|
| Molecular Weight | 212.09 g/mol |
| LogP | 0.8478 |
| Topological Polar Surface Area | 100.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 212.09094 |
| Heavy Atoms | 15 |
| Complexity | 360.52368 |
Chemical Identifiers
| CAS Number | 360573-39-3 |
|---|---|
| SMILES | CCCCNC(=O)C1=C(C=NN1)[N+](=O)[O-] |
Product Overview
N-butyl-4-nitro-1H-pyrazole-5-carboxamide (CAS 360573-39-3), with molecular formula C8H12N4O3 and molecular weight 212.09 g/mol. IUPAC: N-butyl-4-nitro-1H-pyrazole-5-carboxamide.
Chemical Property Profile of N-butyl-4-nitro-1H-pyrazole-5-carboxamide
Property Insights of N-butyl-4-nitro-1H-pyrazole-5-carboxamide
The XLogP value of 0.8478 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-butyl-4-nitro-1H-pyrazole-5-carboxamide. The TPSA of 100.92 Ų falls within the moderate polarity range, balancing permeability and solubility for N-butyl-4-nitro-1H-pyrazole-5-carboxamide. Following Lipinski's Rule of Five, N-butyl-4-nitro-1H-pyrazole-5-carboxamide has 2 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 N-butyl-4-nitro-1H-pyrazole-5-carboxamide?
The CAS number of N-butyl-4-nitro-1H-pyrazole-5-carboxamide is 360573-39-3.
What is the molecular formula of N-butyl-4-nitro-1H-pyrazole-5-carboxamide?
The molecular formula of N-butyl-4-nitro-1H-pyrazole-5-carboxamide is C8H12N4O3.
What is the molecular weight of N-butyl-4-nitro-1H-pyrazole-5-carboxamide?
The molecular weight of N-butyl-4-nitro-1H-pyrazole-5-carboxamide is 212.09 g/mol.
Where can I buy N-butyl-4-nitro-1H-pyrazole-5-carboxamide?
You can request a quote for N-butyl-4-nitro-1H-pyrazole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butyl-4-nitro-1H-pyrazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-4-nitro-1H-pyrazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.