AB00684970-01
TL;DR: AB00684970-01 (CAS 656831-74-2) is a chemical compound with molecular formula C20H17N5O3 and molecular weight 375.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-methoxyphenyl)-2-(4-oxo-1-phenylpyrazolo[5,4-d]pyrimidin-5-yl)acetamide
Also Known As: AB00684970-01, N-(3-methoxyphenyl)-2-{4-oxo-1-phenyl-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-5-yl}acetamide, F0679-0040, N-(3-methoxyphenyl)-2-(4-oxo-1-phenylpyrazolo[3,4-d]pyrimidin-5-yl)acetamide, N-(3-methoxyphenyl)-2-(4-oxo-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-5(4H)-yl)acetamide
| Molecular Formula | C20H17N5O3 |
|---|---|
| Molecular Weight | 375.13 g/mol |
| LogP | 2.2295 |
| Topological Polar Surface Area | 91.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 375.13315 |
| Heavy Atoms | 28 |
| Complexity | 1197.4233 |
Chemical Identifiers
| CAS Number | 656831-74-2 |
|---|---|
| SMILES | COC1=CC=CC(=C1)NC(=O)CN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4 |
Product Overview
AB00684970-01 (CAS 656831-74-2), with molecular formula C20H17N5O3 and molecular weight 375.13 g/mol. IUPAC: N-(3-methoxyphenyl)-2-(4-oxo-1-phenylpyrazolo[5,4-d]pyrimidin-5-yl)acetamide.
Chemical Property Profile of AB00684970-01
Property Insights of AB00684970-01
The XLogP value of 2.2295 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00684970-01. The TPSA of 91.04 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00684970-01. Following Lipinski's Rule of Five, AB00684970-01 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 AB00684970-01?
The CAS number of AB00684970-01 is 656831-74-2.
What is the molecular formula of AB00684970-01?
The molecular formula of AB00684970-01 is C20H17N5O3.
What is the molecular weight of AB00684970-01?
The molecular weight of AB00684970-01 is 375.13 g/mol.
Where can I buy AB00684970-01?
You can request a quote for AB00684970-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00684970-01?
Yes, KEHONG BIO provides custom synthesis services for AB00684970-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.