地芬尼多
TL;DR: 地芬尼多 (CAS 972-02-1) is a chemical compound with molecular formula C21H27NO and molecular weight 309.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
地芬尼多
1,1-diphenyl-4-piperidin-1-ylbutan-1-ol
Also Known As: Difenidol, Vontrol, Nometic, Avomol, Cephadol
| Molecular Formula | C21H27NO |
|---|---|
| Molecular Weight | 309.21 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 309.20926 |
| Heavy Atoms | 23 |
| Complexity | 307.0 |
| Melting Point | 212-214 |
| Solubility | CRYSTALS FROM CHLOROFORM + ETHYL ACETATE; FREELY SOL IN METHANOL; SOL IN WATER & CHLOROFORM; PRACTICALLY INSOL IN ETHER, BENZENE, & PETROLEUM ETHER /HCL/ |
Chemical Identifiers
| CAS Number | 972-02-1 |
|---|---|
| SMILES | C1CCN(CC1)CCCC(C2=CC=CC=C2)(C3=CC=CC=C3)O |
| InChIKey | OGAKLTJNUQRZJU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
地芬尼多 (CAS 972-02-1), with molecular formula C21H27NO and molecular weight 309.21 g/mol. IUPAC: 1,1-diphenyl-4-piperidin-1-ylbutan-1-ol.
Chemical Property Profile of 地芬尼多
Property Insights of 地芬尼多
The XLogP value of 4.2 indicates that 地芬尼多 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.5 Ų, 地芬尼多 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 地芬尼多 has 1 hydrogen bond donor(s) and 2 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 地芬尼多?
The CAS number of 地芬尼多 is 972-02-1.
What is the molecular formula of 地芬尼多?
The molecular formula of 地芬尼多 is C21H27NO.
What is the molecular weight of 地芬尼多?
The molecular weight of 地芬尼多 is 309.21 g/mol.
Where can I buy 地芬尼多?
You can request a quote for 地芬尼多 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 地芬尼多?
Yes, KEHONG BIO provides custom synthesis services for 地芬尼多 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.