AB00672156-01
TL;DR: AB00672156-01 (CAS 852450-46-5) is a chemical compound with molecular formula C20H15ClFN5O2 and molecular weight 411.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-methylphenyl)-2-[1-(4-fluorophenyl)-4-oxopyrazolo[5,4-d]pyrimidin-5-yl]acetamide
Also Known As: AB00672156-01, F0679-0381, N-(3-chloro-4-methylphenyl)-2-(1-(4-fluorophenyl)-4-oxo-1H-pyrazolo[3,4-d]pyrimidin-5(4H)-yl)acetamide, N-(3-chloro-4-methylphenyl)-2-[1-(4-fluorophenyl)-4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-5-yl]acetamide, N-(3-chloro-4-methylphenyl)-2-[1-(4-fluorophenyl)-4-oxopyrazolo[3,4-d]pyrimidin-5-yl]acetamide
| Molecular Formula | C20H15ClFN5O2 |
|---|---|
| Molecular Weight | 411.09 g/mol |
| LogP | 3.32182 |
| Topological Polar Surface Area | 81.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 411.08984 |
| Heavy Atoms | 29 |
| Complexity | 1280.5165 |
Chemical Identifiers
| CAS Number | 852450-46-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C=NN3C4=CC=C(C=C4)F)Cl |
Product Overview
AB00672156-01 (CAS 852450-46-5), with molecular formula C20H15ClFN5O2 and molecular weight 411.09 g/mol. IUPAC: N-(3-chloro-4-methylphenyl)-2-[1-(4-fluorophenyl)-4-oxopyrazolo[5,4-d]pyrimidin-5-yl]acetamide.
Chemical Property Profile of AB00672156-01
Property Insights of AB00672156-01
The XLogP value of 3.32182 indicates that AB00672156-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.81 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00672156-01. Following Lipinski's Rule of Five, AB00672156-01 has 1 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 AB00672156-01?
The CAS number of AB00672156-01 is 852450-46-5.
What is the molecular formula of AB00672156-01?
The molecular formula of AB00672156-01 is C20H15ClFN5O2.
What is the molecular weight of AB00672156-01?
The molecular weight of AB00672156-01 is 411.09 g/mol.
Where can I buy AB00672156-01?
You can request a quote for AB00672156-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00672156-01?
Yes, KEHONG BIO provides custom synthesis services for AB00672156-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.