AB00675435-01
TL;DR: AB00675435-01 (CAS 866870-36-2) is a chemical compound with molecular formula C13H10ClFN4O and molecular weight 292.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-chloro-4-fluorophenyl)methyl]-1-methylpyrazolo[5,4-d]pyrimidin-4-one
Also Known As: AB00675435-01, 5-[(2-chloro-4-fluorophenyl)methyl]-1-methyl-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one, F1607-0169, 5-(2-chloro-4-fluorobenzyl)-1-methyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one, 5-[(2-chloro-4-fluorophenyl)methyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-one
| Molecular Formula | C13H10ClFN4O |
|---|---|
| Molecular Weight | 292.05 g/mol |
| LogP | 1.9708 |
| Topological Polar Surface Area | 52.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 292.0527 |
| Heavy Atoms | 20 |
| Complexity | 855.1887 |
Chemical Identifiers
| CAS Number | 866870-36-2 |
|---|---|
| SMILES | CN1C2=C(C=N1)C(=O)N(C=N2)CC3=C(C=C(C=C3)F)Cl |
Product Overview
AB00675435-01 (CAS 866870-36-2), with molecular formula C13H10ClFN4O and molecular weight 292.05 g/mol. IUPAC: 5-[(2-chloro-4-fluorophenyl)methyl]-1-methylpyrazolo[5,4-d]pyrimidin-4-one.
Chemical Property Profile of AB00675435-01
Property Insights of AB00675435-01
The XLogP value of 1.9708 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00675435-01. With a topological polar surface area (TPSA) of 52.71 Ų, AB00675435-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00675435-01 has 0 hydrogen bond donor(s) and 3 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 AB00675435-01?
The CAS number of AB00675435-01 is 866870-36-2.
What is the molecular formula of AB00675435-01?
The molecular formula of AB00675435-01 is C13H10ClFN4O.
What is the molecular weight of AB00675435-01?
The molecular weight of AB00675435-01 is 292.05 g/mol.
Where can I buy AB00675435-01?
You can request a quote for AB00675435-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00675435-01?
Yes, KEHONG BIO provides custom synthesis services for AB00675435-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.