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N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide
TL;DR: N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide (CAS 525577-57-5) is a chemical compound with molecular formula C13H16N4O4S and molecular weight 324.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide
Also Known As: N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide, N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide, N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-3-nitro-N-methylbenzenesulfonamide, N-[(1-ETHYL-1H-PYRAZOL-4-YL)METHYL]-N-METHYL-3-NITROBENZENE-1-SULFONAMIDE, Cambridge id 7229658
| Molecular Formula | C13H16N4O4S |
|---|---|
| Molecular Weight | 324.09 g/mol |
| LogP | 1.6319 |
| Topological Polar Surface Area | 98.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 324.08923 |
| Heavy Atoms | 22 |
| Complexity | 784.8427 |
Chemical Identifiers
| CAS Number | 525577-57-5 |
|---|---|
| SMILES | CCN1C=C(C=N1)CN(C)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-] |
Product Overview
N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide (CAS 525577-57-5), with molecular formula C13H16N4O4S and molecular weight 324.09 g/mol. IUPAC: N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide.
Chemical Property Profile of N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide
Property Insights of N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide
The XLogP value of 1.6319 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide. The TPSA of 98.34 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide 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 N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide?
The CAS number of N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide is 525577-57-5.
What is the molecular formula of N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide?
The molecular formula of N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide is C13H16N4O4S.
What is the molecular weight of N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide?
The molecular weight of N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide is 324.09 g/mol.
Where can I buy N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide?
You can request a quote for N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(1-ethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.