3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine
TL;DR: 3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine (CAS 355134-49-5) is a chemical compound with molecular formula C12H14N4O2 and molecular weight 246.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-3-amine
Also Known As: BAS 01921079, 3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine, 3-methyl-4-nitro-N-phenethyl-1H-pyrazol-5-amine, 5-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-3-amine, 5-methyl-4-nitro-N-phenethyl-1H-pyrazol-3-amine
| Molecular Formula | C12H14N4O2 |
|---|---|
| Molecular Weight | 246.11 g/mol |
| LogP | 2.28092 |
| Topological Polar Surface Area | 83.85 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 246.11168 |
| Heavy Atoms | 18 |
| Complexity | 536.2654 |
Chemical Identifiers
| CAS Number | 355134-49-5 |
|---|---|
| SMILES | CC1=C(C(=NN1)NCCC2=CC=CC=C2)[N+](=O)[O-] |
Product Overview
3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine (CAS 355134-49-5), with molecular formula C12H14N4O2 and molecular weight 246.11 g/mol. IUPAC: 5-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-3-amine.
Chemical Property Profile of 3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine
Property Insights of 3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine
The XLogP value of 2.28092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine. The TPSA of 83.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine. Following Lipinski's Rule of Five, 3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine 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 3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine?
The CAS number of 3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine is 355134-49-5.
What is the molecular formula of 3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine?
The molecular formula of 3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine is C12H14N4O2.
What is the molecular weight of 3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine?
The molecular weight of 3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine is 246.11 g/mol.
Where can I buy 3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine?
You can request a quote for 3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-4-nitro-N-(2-phenylethyl)-1H-pyrazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.