![4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine structure](/static/products/100/1005041-19-9.png)
4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine
TL;DR: 4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine (CAS 1005041-19-9) is a chemical compound with molecular formula C25H33N3O4 and molecular weight 439.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-3,5-dinitro-2,6-bis(4-propan-2-ylphenyl)piperidine
Also Known As: A3104/0131431, 4,4-dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine, 2,6-bis(4-isopropylphenyl)-4,4-dimethyl-3,5-dinitropiperidine, 4,4-dimethyl-3,5-dinitro-2,6-bis(4-propan-2-ylphenyl)piperidine
| Molecular Formula | C25H33N3O4 |
|---|---|
| Molecular Weight | 439.25 g/mol |
| LogP | 5.6358 |
| Topological Polar Surface Area | 98.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 439.2471 |
| Heavy Atoms | 32 |
| Complexity | 890.18646 |
Chemical Identifiers
| CAS Number | 1005041-19-9 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C2C(C(C(C(N2)C3=CC=C(C=C3)C(C)C)[N+](=O)[O-])(C)C)[N+](=O)[O-] |
Product Overview
4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine (CAS 1005041-19-9), with molecular formula C25H33N3O4 and molecular weight 439.25 g/mol. IUPAC: 4,4-dimethyl-3,5-dinitro-2,6-bis(4-propan-2-ylphenyl)piperidine.
Chemical Property Profile of 4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine
Property Insights of 4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine
The XLogP value of 5.6358 indicates that 4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine. Following Lipinski's Rule of Five, 4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine?
The CAS number of 4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine is 1005041-19-9.
What is the molecular formula of 4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine?
The molecular formula of 4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine is C25H33N3O4.
What is the molecular weight of 4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine?
The molecular weight of 4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine is 439.25 g/mol.
Where can I buy 4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine?
You can request a quote for 4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine?
Yes, KEHONG BIO provides custom synthesis services for 4,4-Dimethyl-3,5-dinitro-2,6-bis[4-(propan-2-yl)phenyl]piperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.