(E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine
TL;DR: (E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine (CAS 304877-60-9) is a chemical compound with molecular formula C13H15N5O2 and molecular weight 273.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,1,3-trimethyl-4-[(3-nitrophenyl)methylideneamino]pyrazol-5-amine
Also Known As: N,2,5-trimethyl-4-[(3-nitrophenyl)methylideneamino]pyrazol-3-amine, (E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine
| Molecular Formula | C13H15N5O2 |
|---|---|
| Molecular Weight | 273.12 g/mol |
| LogP | 2.42902 |
| Topological Polar Surface Area | 85.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 273.1226 |
| Heavy Atoms | 20 |
| Complexity | 675.3962 |
Chemical Identifiers
| CAS Number | 304877-60-9 |
|---|---|
| SMILES | CC1=NN(C(=C1N=CC2=CC(=CC=C2)[N+](=O)[O-])NC)C |
Product Overview
(E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine (CAS 304877-60-9), with molecular formula C13H15N5O2 and molecular weight 273.12 g/mol. IUPAC: N,1,3-trimethyl-4-[(3-nitrophenyl)methylideneamino]pyrazol-5-amine.
Chemical Property Profile of (E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine
Property Insights of (E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine
The XLogP value of 2.42902 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine. The TPSA of 85.35 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine. Following Lipinski's Rule of Five, (E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine has 1 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 (E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine?
The CAS number of (E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine is 304877-60-9.
What is the molecular formula of (E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine?
The molecular formula of (E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine is C13H15N5O2.
What is the molecular weight of (E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine?
The molecular weight of (E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine is 273.12 g/mol.
Where can I buy (E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine?
You can request a quote for (E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine?
Yes, KEHONG BIO provides custom synthesis services for (E)-N5,1,3-trimethyl-N4-(3-nitrobenzylidene)-1H-pyrazole-4,5-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.