![3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile structure](/static/products/304/304870-83-5.png)
3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile
TL;DR: 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile (CAS 304870-83-5) is a chemical compound with molecular formula C26H31N5O4 and molecular weight 477.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile
Also Known As: 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile, 3,3-DIMETHYL-8-(2-METHYLPROPYL)-6-[4-(4-NITROBENZOYL)PIPERAZIN-1-YL]-1H,3H,4H-PYRANO[3,4-C]PYRIDINE-5-CARBONITRILE, 3,3-dimethyl-8-(2-methylpropyl)-6-{4-[(4-nitrophenyl)carbonyl]piperazin-1-yl}-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile, 3,3-dimethyl-8-(2-methylpropyl)-6-{4-[(4-nitrophenyl)carbonyl]piperazinyl}-3,4 -dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile, 8-isobutyl-3,3-dimethyl-6-(4-(4-nitrobenzoyl)piperazin-1-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
| Molecular Formula | C26H31N5O4 |
|---|---|
| Molecular Weight | 477.24 g/mol |
| LogP | 3.87368 |
| Topological Polar Surface Area | 112.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 477.2376 |
| Heavy Atoms | 35 |
| Complexity | 1175.7089 |
Chemical Identifiers
| CAS Number | 304870-83-5 |
|---|---|
| SMILES | CC(C)CC1=NC(=C(C2=C1COC(C2)(C)C)C#N)N3CCN(CC3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile (CAS 304870-83-5), with molecular formula C26H31N5O4 and molecular weight 477.24 g/mol. IUPAC: 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile.
Chemical Property Profile of 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile
Property Insights of 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile
The XLogP value of 3.87368 indicates that 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile. Following Lipinski's Rule of Five, 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile has 0 hydrogen bond donor(s) and 7 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 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile?
The CAS number of 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile is 304870-83-5.
What is the molecular formula of 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile?
The molecular formula of 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile is C26H31N5O4.
What is the molecular weight of 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile?
The molecular weight of 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile is 477.24 g/mol.
Where can I buy 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile?
You can request a quote for 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3,3-dimethyl-8-(2-methylpropyl)-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.