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6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one
TL;DR: 6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one (CAS 429622-30-0) is a chemical compound with molecular formula C15H15N3O and molecular weight 253.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzyl-2,5-dimethyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
Also Known As: BAS 03107143, 6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one, AO-081/15245259, 6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-ol, BRD-K43005467-001-07-4
| Molecular Formula | C15H15N3O |
|---|---|
| Molecular Weight | 253.12 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.1215 |
| Heavy Atoms | 19 |
| Complexity | 496.0 |
Chemical Identifiers
| CAS Number | 429622-30-0 |
|---|---|
| SMILES | CC1=CC2=NC(=C(C(=O)N2N1)CC3=CC=CC=C3)C |
| InChIKey | CZGHWZCHFCPVCI-UHFFFAOYSA-N |
Product Overview
6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one (CAS 429622-30-0), with molecular formula C15H15N3O and molecular weight 253.12 g/mol. IUPAC: 6-benzyl-2,5-dimethyl-1H-pyrazolo[1,5-a]pyrimidin-7-one.
Chemical Property Profile of 6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one
Property Insights of 6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one. With a topological polar surface area (TPSA) of 44.7 Ų, 6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one has 1 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 6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one?
The CAS number of 6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one is 429622-30-0.
What is the molecular formula of 6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one?
The molecular formula of 6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one is C15H15N3O.
What is the molecular weight of 6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one?
The molecular weight of 6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one is 253.12 g/mol.
Where can I buy 6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one?
You can request a quote for 6-benzyl-2,5-dimethylpyrazolo[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 6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for 6-benzyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.