ChemDiv2_006684
TL;DR: ChemDiv2_006684 (CAS 901042-96-4) is a chemical compound with molecular formula C20H17ClN4O2 and molecular weight 380.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chlorophenyl)-5-(4-ethoxyphenyl)-6-methylpyrazolo[5,4-d]pyrimidin-4-one
Also Known As: ChemDiv2_006684, IDI1_005399, 1-(2-chlorophenyl)-5-(4-ethoxyphenyl)-6-methyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one, AP-064/43237336, 1-(2-chlorophenyl)-5-(4-ethoxyphenyl)-6-methylpyrazolo[3,4-d]pyrimidin-4-one
| Molecular Formula | C20H17ClN4O2 |
|---|---|
| Molecular Weight | 380.10 g/mol |
| LogP | 3.93192 |
| Topological Polar Surface Area | 61.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.104 |
| Heavy Atoms | 27 |
| Complexity | 1179.029 |
Chemical Identifiers
| CAS Number | 901042-96-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=NC3=C(C2=O)C=NN3C4=CC=CC=C4Cl)C |
Product Overview
ChemDiv2_006684 (CAS 901042-96-4), with molecular formula C20H17ClN4O2 and molecular weight 380.10 g/mol. IUPAC: 1-(2-chlorophenyl)-5-(4-ethoxyphenyl)-6-methylpyrazolo[5,4-d]pyrimidin-4-one.
Chemical Property Profile of ChemDiv2_006684
Property Insights of ChemDiv2_006684
The XLogP value of 3.93192 indicates that ChemDiv2_006684 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.94 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_006684. Following Lipinski's Rule of Five, ChemDiv2_006684 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 ChemDiv2_006684?
The CAS number of ChemDiv2_006684 is 901042-96-4.
What is the molecular formula of ChemDiv2_006684?
The molecular formula of ChemDiv2_006684 is C20H17ClN4O2.
What is the molecular weight of ChemDiv2_006684?
The molecular weight of ChemDiv2_006684 is 380.10 g/mol.
Where can I buy ChemDiv2_006684?
You can request a quote for ChemDiv2_006684 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_006684?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_006684 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.