1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole
TL;DR: 1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole (CAS 354576-98-0) is a chemical compound with molecular formula C17H14ClN3O2 and molecular weight 327.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole
Also Known As: BAS 00858252, 1-(4-chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole, 1-(4-chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)-1H-pyrazole, 1-(4-Chloro-phenyl)-3,5-dimethyl-4-(3-nitro-phenyl)-1H-pyrazole
| Molecular Formula | C17H14ClN3O2 |
|---|---|
| Molecular Weight | 327.08 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 327.07745 |
| Heavy Atoms | 23 |
| Complexity | 423.0 |
Chemical Identifiers
| CAS Number | 354576-98-0 |
|---|---|
| SMILES | CC1=C(C(=NN1C2=CC=C(C=C2)Cl)C)C3=CC(=CC=C3)[N+](=O)[O-] |
| InChIKey | RRPWMCMVDAKDQQ-UHFFFAOYSA-N |
Product Overview
1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole (CAS 354576-98-0), with molecular formula C17H14ClN3O2 and molecular weight 327.08 g/mol. IUPAC: 1-(4-chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole.
Chemical Property Profile of 1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole
Property Insights of 1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole
The XLogP value of 4.8 indicates that 1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole has 0 hydrogen bond donor(s) and 3 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 1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole?
The CAS number of 1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole is 354576-98-0.
What is the molecular formula of 1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole?
The molecular formula of 1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole is C17H14ClN3O2.
What is the molecular weight of 1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole?
The molecular weight of 1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole is 327.08 g/mol.
Where can I buy 1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole?
You can request a quote for 1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorophenyl)-3,5-dimethyl-4-(3-nitrophenyl)pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.