ChemDiv3_005425
TL;DR: ChemDiv3_005425 (CAS 374096-34-1) is a chemical compound with molecular formula C26H32N4O2 and molecular weight 432.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-benzyl-6-(4-butanoylpiperazin-1-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile
Also Known As: ChemDiv3_005425, IDI1_023335, BRD-K34049153-001-01-5, 8-benzyl-6-(4-butanoylpiperazin-1-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile, 8-BENZYL-6-(4-BUTANOYLPIPERAZIN-1-YL)-3,3-DIMETHYL-1H,3H,4H-PYRANO[3,4-C]PYRIDINE-5-CARBONITRILE
| Molecular Formula | C26H32N4O2 |
|---|---|
| Molecular Weight | 432.25 g/mol |
| LogP | 3.84408 |
| Topological Polar Surface Area | 69.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 432.25253 |
| Heavy Atoms | 32 |
| Complexity | 1018.3578 |
Chemical Identifiers
| CAS Number | 374096-34-1 |
|---|---|
| SMILES | CCCC(=O)N1CCN(CC1)C2=C(C3=C(COC(C3)(C)C)C(=N2)CC4=CC=CC=C4)C#N |
Product Overview
ChemDiv3_005425 (CAS 374096-34-1), with molecular formula C26H32N4O2 and molecular weight 432.25 g/mol. IUPAC: 8-benzyl-6-(4-butanoylpiperazin-1-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile.
Chemical Property Profile of ChemDiv3_005425
Property Insights of ChemDiv3_005425
The XLogP value of 3.84408 indicates that ChemDiv3_005425 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.46 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_005425. Following Lipinski's Rule of Five, ChemDiv3_005425 has 0 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 ChemDiv3_005425?
The CAS number of ChemDiv3_005425 is 374096-34-1.
What is the molecular formula of ChemDiv3_005425?
The molecular formula of ChemDiv3_005425 is C26H32N4O2.
What is the molecular weight of ChemDiv3_005425?
The molecular weight of ChemDiv3_005425 is 432.25 g/mol.
Where can I buy ChemDiv3_005425?
You can request a quote for ChemDiv3_005425 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_005425?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_005425 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.