4,4-二苯基-6-哌啶子基-3-己酮硝酸盐
TL;DR: 4,4-二苯基-6-哌啶子基-3-己酮硝酸盐 (CAS 67227-16-1) is a chemical compound with molecular formula C23H30N2O4 and molecular weight 398.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-二苯基-6-哌啶子基-3-己酮硝酸盐
4,4-diphenyl-6-piperidin-1-ium-1-ylhexan-3-one nitrate
Also Known As: 4,4-Diphenyl-6-piperidino-3-hexanone nitrate, 3-HEXANONE, 4,4-DIPHENYL-6-PIPERIDINO-, NITRATE, 1-(4-Oxo-3,3-diphenylhexyl)piperidin-1-ium nitrate, 3-Hexanone, 4,4-diphenyl-6-(1-piperidinyl)-, nitrate, 4,4-diphenyl-6-piperidin-1-ium-1-ylhexan-3-one nitrate
| Molecular Formula | C23H30N2O4 |
|---|---|
| Molecular Weight | 398.22 g/mol |
| LogP | 3.17 |
| Topological Polar Surface Area | 84.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 398.22055 |
| Heavy Atoms | 29 |
| Complexity | 401.0 |
Chemical Identifiers
| CAS Number | 67227-16-1 |
|---|---|
| SMILES | CCC(=O)C(CC[NH+]1CCCCC1)(C2=CC=CC=C2)C3=CC=CC=C3.[N+](=O)([O-])[O-] |
| InChIKey | ZLIHZFGYUSONTH-UHFFFAOYSA-O |
Product Overview
4,4-二苯基-6-哌啶子基-3-己酮硝酸盐 (CAS 67227-16-1), with molecular formula C23H30N2O4 and molecular weight 398.22 g/mol. IUPAC: 4,4-diphenyl-6-piperidin-1-ium-1-ylhexan-3-one nitrate.
Chemical Property Profile of 4,4-二苯基-6-哌啶子基-3-己酮硝酸盐
Property Insights of 4,4-二苯基-6-哌啶子基-3-己酮硝酸盐
The XLogP value of 3.17 indicates that 4,4-二苯基-6-哌啶子基-3-己酮硝酸盐 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4-二苯基-6-哌啶子基-3-己酮硝酸盐. Following Lipinski's Rule of Five, 4,4-二苯基-6-哌啶子基-3-己酮硝酸盐 has 1 hydrogen bond donor(s) and 4 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 4,4-二苯基-6-哌啶子基-3-己酮硝酸盐?
The CAS number of 4,4-二苯基-6-哌啶子基-3-己酮硝酸盐 is 67227-16-1.
What is the molecular formula of 4,4-二苯基-6-哌啶子基-3-己酮硝酸盐?
The molecular formula of 4,4-二苯基-6-哌啶子基-3-己酮硝酸盐 is C23H30N2O4.
What is the molecular weight of 4,4-二苯基-6-哌啶子基-3-己酮硝酸盐?
The molecular weight of 4,4-二苯基-6-哌啶子基-3-己酮硝酸盐 is 398.22 g/mol.
Where can I buy 4,4-二苯基-6-哌啶子基-3-己酮硝酸盐?
You can request a quote for 4,4-二苯基-6-哌啶子基-3-己酮硝酸盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4-二苯基-6-哌啶子基-3-己酮硝酸盐?
Yes, KEHONG BIO provides custom synthesis services for 4,4-二苯基-6-哌啶子基-3-己酮硝酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.