![4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide structure](/static/products/680/680180-92-1.png)
4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide
TL;DR: 4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide (CAS 680180-92-1) is a chemical compound with molecular formula C17H20N6O and molecular weight 324.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N'-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxybenzenecarboximidamide
Also Known As: 4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide, 4-tert-butyl-N''-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzamidine, 4-(tert-Butyl)-N-((1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy)benzimidamide, 4-tert-butyl-N''''-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-benzenecarboximidamide, 4-tert-butyl-N''''-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)oxybenzenecarboximidamide
| Molecular Formula | C17H20N6O |
|---|---|
| Molecular Weight | 324.17 g/mol |
| LogP | 2.3601 |
| Topological Polar Surface Area | 91.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.16986 |
| Heavy Atoms | 24 |
| Complexity | 889.5799 |
Chemical Identifiers
| CAS Number | 680180-92-1 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)/C(=N/OC2=NC=NC3=C2C=NN3C)/N |
Product Overview
4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide (CAS 680180-92-1), with molecular formula C17H20N6O and molecular weight 324.17 g/mol. IUPAC: 4-tert-butyl-N'-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxybenzenecarboximidamide.
Chemical Property Profile of 4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide
Property Insights of 4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide
The XLogP value of 2.3601 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide. The TPSA of 91.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide. Following Lipinski's Rule of Five, 4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide has 1 hydrogen bond donor(s) and 5 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 4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide?
The CAS number of 4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide is 680180-92-1.
What is the molecular formula of 4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide?
The molecular formula of 4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide is C17H20N6O.
What is the molecular weight of 4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide?
The molecular weight of 4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide is 324.17 g/mol.
Where can I buy 4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide?
You can request a quote for 4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(tert-butyl)-N'-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)oxy]benzenecarboximidamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.