1,3-Di(1H-pyrazol-4-yl)benzene
TL;DR: 1,3-Di(1H-pyrazol-4-yl)benzene (CAS 958101-27-4) is a chemical compound with molecular formula C12H10N4 and molecular weight 210.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(1H-pyrazol-4-yl)phenyl]-1H-pyrazole
Also Known As: 1,3-Di(1H-pyrazol-4-yl)benzene, 4-[3-(1H-pyrazol-4-yl)phenyl]-1H-pyrazole, 13-Di(1H-pyrazol-4-yl)benzene, 4-(3-(1H-Pyrazol-4-yl)phenyl)-1H-pyrazole, 1(3)-Di(1H-pyrazol-4-yl)benzene
| Molecular Formula | C12H10N4 |
|---|---|
| Molecular Weight | 210.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 57.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.09055 |
| Heavy Atoms | 16 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 958101-27-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C2=CNN=C2)C3=CNN=C3 |
| InChIKey | GSRYHHVNYJOBBE-UHFFFAOYSA-N |
Product Overview
1,3-Di(1H-pyrazol-4-yl)benzene (CAS 958101-27-4), with molecular formula C12H10N4 and molecular weight 210.09 g/mol. IUPAC: 4-[3-(1H-pyrazol-4-yl)phenyl]-1H-pyrazole.
Chemical Property Profile of 1,3-Di(1H-pyrazol-4-yl)benzene
Property Insights of 1,3-Di(1H-pyrazol-4-yl)benzene
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Di(1H-pyrazol-4-yl)benzene. With a topological polar surface area (TPSA) of 57.4 Ų, 1,3-Di(1H-pyrazol-4-yl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Di(1H-pyrazol-4-yl)benzene has 2 hydrogen bond donor(s) and 2 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 1,3-Di(1H-pyrazol-4-yl)benzene?
The CAS number of 1,3-Di(1H-pyrazol-4-yl)benzene is 958101-27-4.
What is the molecular formula of 1,3-Di(1H-pyrazol-4-yl)benzene?
The molecular formula of 1,3-Di(1H-pyrazol-4-yl)benzene is C12H10N4.
What is the molecular weight of 1,3-Di(1H-pyrazol-4-yl)benzene?
The molecular weight of 1,3-Di(1H-pyrazol-4-yl)benzene is 210.09 g/mol.
Where can I buy 1,3-Di(1H-pyrazol-4-yl)benzene?
You can request a quote for 1,3-Di(1H-pyrazol-4-yl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Di(1H-pyrazol-4-yl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Di(1H-pyrazol-4-yl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.