Diantipyryl(2-furyl)methan
TL;DR: Diantipyryl(2-furyl)methan (CAS 2497-56-5) is a chemical compound with molecular formula C27H26N4O3 and molecular weight 454.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-(furan-2-yl)methyl]-1,5-dimethyl-2-phenylpyrazol-3-one
Also Known As: Diantipyryl(2-furyl)methan, BAS 00684248, BIM-0017637.P001, F0862-0037, 4,4'-(furan-2-ylmethylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one)
| Molecular Formula | C27H26N4O3 |
|---|---|
| Molecular Weight | 454.20 g/mol |
| LogP | 4.05544 |
| Topological Polar Surface Area | 67.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 454.2005 |
| Heavy Atoms | 34 |
| Complexity | 1463.2926 |
Chemical Identifiers
| CAS Number | 2497-56-5 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(C3=CC=CO3)C4=C(N(N(C4=O)C5=CC=CC=C5)C)C |
Product Overview
Diantipyryl(2-furyl)methan (CAS 2497-56-5), with molecular formula C27H26N4O3 and molecular weight 454.20 g/mol. IUPAC: 4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-(furan-2-yl)methyl]-1,5-dimethyl-2-phenylpyrazol-3-one.
Chemical Property Profile of Diantipyryl(2-furyl)methan
Property Insights of Diantipyryl(2-furyl)methan
The XLogP value of 4.05544 indicates that Diantipyryl(2-furyl)methan is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diantipyryl(2-furyl)methan. Following Lipinski's Rule of Five, Diantipyryl(2-furyl)methan 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 Diantipyryl(2-furyl)methan?
The CAS number of Diantipyryl(2-furyl)methan is 2497-56-5.
What is the molecular formula of Diantipyryl(2-furyl)methan?
The molecular formula of Diantipyryl(2-furyl)methan is C27H26N4O3.
What is the molecular weight of Diantipyryl(2-furyl)methan?
The molecular weight of Diantipyryl(2-furyl)methan is 454.20 g/mol.
Where can I buy Diantipyryl(2-furyl)methan?
You can request a quote for Diantipyryl(2-furyl)methan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diantipyryl(2-furyl)methan?
Yes, KEHONG BIO provides custom synthesis services for Diantipyryl(2-furyl)methan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.