ChemDiv2_007626
TL;DR: ChemDiv2_007626 (CAS 852440-31-4) is a chemical compound with molecular formula C23H23N5O4 and molecular weight 433.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-oxo-1-phenylpyrazolo[5,4-d]pyrimidin-5-yl)acetamide
Also Known As: ChemDiv2_007626, IDI1_006341, F0679-0071, N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{4-oxo-1-phenyl-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-5-yl}acetamide, N-(3,4-dimethoxyphenethyl)-2-(4-oxo-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-5(4H)-yl)acetamide
| Molecular Formula | C23H23N5O4 |
|---|---|
| Molecular Weight | 433.18 g/mol |
| LogP | 1.9583 |
| Topological Polar Surface Area | 100.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 433.17502 |
| Heavy Atoms | 32 |
| Complexity | 1296.9883 |
Chemical Identifiers
| CAS Number | 852440-31-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNC(=O)CN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4)OC |
Product Overview
ChemDiv2_007626 (CAS 852440-31-4), with molecular formula C23H23N5O4 and molecular weight 433.18 g/mol. IUPAC: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-oxo-1-phenylpyrazolo[5,4-d]pyrimidin-5-yl)acetamide.
Chemical Property Profile of ChemDiv2_007626
Property Insights of ChemDiv2_007626
The XLogP value of 1.9583 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv2_007626. The TPSA of 100.27 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_007626. Following Lipinski's Rule of Five, ChemDiv2_007626 has 1 hydrogen bond donor(s) and 6 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_007626?
The CAS number of ChemDiv2_007626 is 852440-31-4.
What is the molecular formula of ChemDiv2_007626?
The molecular formula of ChemDiv2_007626 is C23H23N5O4.
What is the molecular weight of ChemDiv2_007626?
The molecular weight of ChemDiv2_007626 is 433.18 g/mol.
Where can I buy ChemDiv2_007626?
You can request a quote for ChemDiv2_007626 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_007626?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_007626 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.