![5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one structure](/static/products/832/832138-54-2.png)
5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one
TL;DR: 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one (CAS 832138-54-2) is a chemical compound with molecular formula C16H16ClFN4OS and molecular weight 366.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one
Also Known As: 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one, 5-[(2-chloro-4-fluorobenzyl)sulfanyl]-2,6-diethyl-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
| Molecular Formula | C16H16ClFN4OS |
|---|---|
| Molecular Weight | 366.07 g/mol |
| LogP | 3.7176 |
| Topological Polar Surface Area | 52.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.07175 |
| Heavy Atoms | 24 |
| Complexity | 953.1358 |
Chemical Identifiers
| CAS Number | 832138-54-2 |
|---|---|
| SMILES | CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC3=C(C=C(C=C3)F)Cl)CC |
Product Overview
5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one (CAS 832138-54-2), with molecular formula C16H16ClFN4OS and molecular weight 366.07 g/mol. IUPAC: 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one.
Chemical Property Profile of 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one
Property Insights of 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one
The XLogP value of 3.7176 indicates that 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.71 Ų, 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one 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 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one?
The CAS number of 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one is 832138-54-2.
What is the molecular formula of 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one?
The molecular formula of 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one is C16H16ClFN4OS.
What is the molecular weight of 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one?
The molecular weight of 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one is 366.07 g/mol.
Where can I buy 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one?
You can request a quote for 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one?
Yes, KEHONG BIO provides custom synthesis services for 5-[(2-chloro-4-fluorophenyl)methylsulfanyl]-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.