![1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine structure](/static/products/4018/401828-10-2.webp)
1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine
TL;DR: 1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine (CAS 401828-10-2) is a chemical compound with molecular formula C16H17N5 and molecular weight 279.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-4-pyrrolidin-1-ylpyrazolo[5,4-d]pyrimidine
Also Known As: 1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine, 1-benzyl-4-pyrrolidinylpyrazolo[5,4-d]pyrimidine, AF-399/09975009, 1-benzyl-4-pyrrolidin-1-ylpyrazolo[3,4-d]pyrimidine
| Molecular Formula | C16H17N5 |
|---|---|
| Molecular Weight | 279.15 g/mol |
| LogP | 2.4748 |
| Topological Polar Surface Area | 46.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.1484 |
| Heavy Atoms | 21 |
| Complexity | 743.7081 |
Chemical Identifiers
| CAS Number | 401828-10-2 |
|---|---|
| SMILES | C1CCN(C1)C2=NC=NC3=C2C=NN3CC4=CC=CC=C4 |
Product Overview
1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine (CAS 401828-10-2), with molecular formula C16H17N5 and molecular weight 279.15 g/mol. IUPAC: 1-benzyl-4-pyrrolidin-1-ylpyrazolo[5,4-d]pyrimidine.
Chemical Property Profile of 1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine
Property Insights of 1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine
The XLogP value of 2.4748 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine. With a topological polar surface area (TPSA) of 46.84 Ų, 1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine 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 1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine?
The CAS number of 1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine is 401828-10-2.
What is the molecular formula of 1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine?
The molecular formula of 1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine is C16H17N5.
What is the molecular weight of 1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine?
The molecular weight of 1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine is 279.15 g/mol.
Where can I buy 1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine?
You can request a quote for 1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 1-benzyl-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.