![4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile structure](/static/products/312/312308-82-0.png)
4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
TL;DR: 4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile (CAS 312308-82-0) is a chemical compound with molecular formula C27H28N6O and molecular weight 452.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(1-adamantyl)-1-phenylpyrazol-4-yl]-6-amino-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Also Known As: 4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 4-[3-(1-adamantyl)-1-phenylpyrazol-4-yl]-6-amino-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-3-methyl-4-[1-phenyl-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazol-4-yl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
| Molecular Formula | C27H28N6O |
|---|---|
| Molecular Weight | 452.23 g/mol |
| LogP | 4.5898 |
| Topological Polar Surface Area | 105.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 452.23245 |
| Heavy Atoms | 34 |
| Complexity | 1322.1183 |
Chemical Identifiers
| CAS Number | 312308-82-0 |
|---|---|
| SMILES | CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CN(N=C3C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7 |
Product Overview
4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile (CAS 312308-82-0), with molecular formula C27H28N6O and molecular weight 452.23 g/mol. IUPAC: 4-[3-(1-adamantyl)-1-phenylpyrazol-4-yl]-6-amino-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile.
Chemical Property Profile of 4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Property Insights of 4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
The XLogP value of 4.5898 indicates that 4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile. Following Lipinski's Rule of Five, 4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile has 2 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-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile?
The CAS number of 4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile is 312308-82-0.
What is the molecular formula of 4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile?
The molecular formula of 4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile is C27H28N6O.
What is the molecular weight of 4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile?
The molecular weight of 4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile is 452.23 g/mol.
Where can I buy 4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile?
You can request a quote for 4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-((1R,3s)-adamantan-1-yl)-1-phenyl-1H-pyrazol-4-yl)-6-amino-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.