Diantipyrylmethane
TL;DR: Diantipyrylmethane (CAS 1251-85-0) is a chemical compound with molecular formula C23H24N4O2 and molecular weight 388.19 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)methyl]-1,5-dimethyl-2-phenylpyrazol-3-one
Also Known As: Diantipyrylmethane, Diantipyrinylmethane, trichachnine, Bisantipyrylmethane, Diantipyryl methane
| Molecular Formula | C23H24N4O2 |
|---|---|
| Molecular Weight | 388.19 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 47.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 388.1899 |
| Heavy Atoms | 29 |
| Complexity | 682.0 |
Chemical Identifiers
| CAS Number | 1251-85-0 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)CC3=C(N(N(C3=O)C4=CC=CC=C4)C)C |
| InChIKey | QATHNKNPUVVKHK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diantipyrylmethane (CAS 1251-85-0), with molecular formula C23H24N4O2 and molecular weight 388.19 g/mol. IUPAC: 4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)methyl]-1,5-dimethyl-2-phenylpyrazol-3-one.
Chemical Property Profile of Diantipyrylmethane
Property Insights of Diantipyrylmethane
The XLogP value of 4.0 indicates that Diantipyrylmethane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.1 Ų, Diantipyrylmethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diantipyrylmethane 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 Diantipyrylmethane?
The CAS number of Diantipyrylmethane is 1251-85-0.
What is the molecular formula of Diantipyrylmethane?
The molecular formula of Diantipyrylmethane is C23H24N4O2.
What is the molecular weight of Diantipyrylmethane?
The molecular weight of Diantipyrylmethane is 388.19 g/mol.
Where can I buy Diantipyrylmethane?
You can request a quote for Diantipyrylmethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diantipyrylmethane?
Yes, KEHONG BIO provides custom synthesis services for Diantipyrylmethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.