4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole
TL;DR: 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole (CAS 5669-86-3) is a chemical compound with molecular formula C21H15N3O2S and molecular weight 373.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole
Also Known As: 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole, 4-[(2-nitrophenyl)thio]-3,5-diphenyl-1H-pyrazole, 4-[(2-NITROPHENYL)SULFANYL]-3,5-DIPHENYL-1H-PYRAZOLE
| Molecular Formula | C21H15N3O2S |
|---|---|
| Molecular Weight | 373.09 g/mol |
| LogP | 5.8031 |
| Topological Polar Surface Area | 71.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.0885 |
| Heavy Atoms | 27 |
| Complexity | 1022.05414 |
Chemical Identifiers
| CAS Number | 5669-86-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(C(=NN2)C3=CC=CC=C3)SC4=CC=CC=C4[N+](=O)[O-] |
Product Overview
4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole (CAS 5669-86-3), with molecular formula C21H15N3O2S and molecular weight 373.09 g/mol. IUPAC: 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole.
Chemical Property Profile of 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole
Property Insights of 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole
The XLogP value of 5.8031 indicates that 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole. Following Lipinski's Rule of Five, 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole?
The CAS number of 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole is 5669-86-3.
What is the molecular formula of 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole?
The molecular formula of 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole is C21H15N3O2S.
What is the molecular weight of 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole?
The molecular weight of 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole is 373.09 g/mol.
Where can I buy 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole?
You can request a quote for 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-nitrophenyl)sulfanyl-3,5-diphenyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.