ChemDiv1_014276
TL;DR: ChemDiv1_014276 (CAS 393786-73-7) is a chemical compound with molecular formula C22H19N7O and molecular weight 397.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-dimethyl-2-phenyl-4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]pyrazol-3-one
Also Known As: ChemDiv1_014276, CBKinase1_002449, CBKinase1_014849, BRD-K11834760-001-01-2, 1,5-dimethyl-2-phenyl-4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]pyrazol-3-one
| Molecular Formula | C22H19N7O |
|---|---|
| Molecular Weight | 397.17 g/mol |
| LogP | 3.35692 |
| Topological Polar Surface Area | 82.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 397.1651 |
| Heavy Atoms | 30 |
| Complexity | 1398.4891 |
Chemical Identifiers
| CAS Number | 393786-73-7 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=C4C=NN(C4=NC=N3)C5=CC=CC=C5 |
Product Overview
ChemDiv1_014276 (CAS 393786-73-7), with molecular formula C22H19N7O and molecular weight 397.17 g/mol. IUPAC: 1,5-dimethyl-2-phenyl-4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]pyrazol-3-one.
Chemical Property Profile of ChemDiv1_014276
Property Insights of ChemDiv1_014276
The XLogP value of 3.35692 indicates that ChemDiv1_014276 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.56 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_014276. Following Lipinski's Rule of Five, ChemDiv1_014276 has 1 hydrogen bond donor(s) and 5 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 ChemDiv1_014276?
The CAS number of ChemDiv1_014276 is 393786-73-7.
What is the molecular formula of ChemDiv1_014276?
The molecular formula of ChemDiv1_014276 is C22H19N7O.
What is the molecular weight of ChemDiv1_014276?
The molecular weight of ChemDiv1_014276 is 397.17 g/mol.
Where can I buy ChemDiv1_014276?
You can request a quote for ChemDiv1_014276 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014276?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014276 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.