![5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one structure](/static/products/890/890095-59-7.png)
5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
TL;DR: 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one (CAS 890095-59-7) is a chemical compound with molecular formula C13H10ClN3O and molecular weight 259.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(chloromethyl)-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
Also Known As: 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one, 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7-ol, 5-(Chloromethyl)-3-phenylpyrazolo-[1,5-a]pyrimidin-7-ol, 5-(chloromethyl)-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one, 5-(chloromethyl)-3-phenylpyrazolo[1,5-{a}]pyrimidin-7(4{H})-one
| Molecular Formula | C13H10ClN3O |
|---|---|
| Molecular Weight | 259.05 g/mol |
| LogP | 2.4284 |
| Topological Polar Surface Area | 50.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.05124 |
| Heavy Atoms | 18 |
| Complexity | 745.7674 |
Chemical Identifiers
| CAS Number | 890095-59-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CNN3C2=NC(=CC3=O)CCl |
Product Overview
5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one (CAS 890095-59-7), with molecular formula C13H10ClN3O and molecular weight 259.05 g/mol. IUPAC: 5-(chloromethyl)-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one.
Chemical Property Profile of 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
Property Insights of 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
The XLogP value of 2.4284 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one. With a topological polar surface area (TPSA) of 50.16 Ų, 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one has 1 hydrogen bond donor(s) and 2 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-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one?
The CAS number of 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one is 890095-59-7.
What is the molecular formula of 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one?
The molecular formula of 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one is C13H10ClN3O.
What is the molecular weight of 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one?
The molecular weight of 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one is 259.05 g/mol.
Where can I buy 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one?
You can request a quote for 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(chloromethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.