3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole
TL;DR: 3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole (CAS 322688-66-4) is a chemical compound with molecular formula C15H18N4O2 and molecular weight 286.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole
Also Known As: 3,5-dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole, 3,5-dimethyl-1-(2-nitro-5-pyrrolidinylphenyl)pyrazole, 1-[2-nitro-5-(1-pyrrolidinyl)phenyl]-3,5-dimethyl-1H-pyrazole, 3,5-dimethyl-1-(2-nitro-5-(pyrrolidin-1-yl)phenyl)-1H-pyrazole, 3,5-dimethyl-1-[2-nitro-5-(pyrrolidin-1-yl)phenyl]-1H-pyrazole
| Molecular Formula | C15H18N4O2 |
|---|---|
| Molecular Weight | 286.14 g/mol |
| LogP | 2.99754 |
| Topological Polar Surface Area | 64.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 286.14297 |
| Heavy Atoms | 21 |
| Complexity | 686.97723 |
Chemical Identifiers
| CAS Number | 322688-66-4 |
|---|---|
| SMILES | CC1=CC(=NN1C2=C(C=CC(=C2)N3CCCC3)[N+](=O)[O-])C |
Product Overview
3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole (CAS 322688-66-4), with molecular formula C15H18N4O2 and molecular weight 286.14 g/mol. IUPAC: 3,5-dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole.
Chemical Property Profile of 3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole
Property Insights of 3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole
The XLogP value of 2.99754 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole. The TPSA of 64.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole. Following Lipinski's Rule of Five, 3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole has 0 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 3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole?
The CAS number of 3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole is 322688-66-4.
What is the molecular formula of 3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole?
The molecular formula of 3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole is C15H18N4O2.
What is the molecular weight of 3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole?
The molecular weight of 3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole is 286.14 g/mol.
Where can I buy 3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole?
You can request a quote for 3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dimethyl-1-(2-nitro-5-pyrrolidin-1-ylphenyl)pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.