苯芴醇
TL;DR: 苯芴醇 (CAS 82186-77-4) is a chemical compound with molecular formula C30H32Cl3NO and molecular weight 527.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苯芴醇
2-(dibutylamino)-1-[2,7-dichloro-9-[(4-chlorophenyl)methylidene]fluoren-4-yl]ethanol
Also Known As: Lumefantrine, Lumefantrine-d18, Lumefantrine D18, (Z)-2-(Dibutylamino)-1-(2,7-dichloro-9-(4-chlorobenzylidene)-9H-fluoren-4-yl)ethanol, HSDB 7210; HSDB7210; HSDB-7210 ; Benflumetol
| Molecular Formula | C30H32Cl3NO |
|---|---|
| Molecular Weight | 527.15 g/mol |
| LogP | 8.7 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 527.15497 |
| Heavy Atoms | 35 |
| Complexity | 671.0 |
Chemical Identifiers
| CAS Number | 82186-77-4 |
|---|---|
| SMILES | CCCCN(CCCC)CC(C1=CC(=CC2=C1C3=C(C2=CC4=CC=C(C=C4)Cl)C=C(C=C3)Cl)Cl)O |
| InChIKey | DYLGFOYVTXJFJP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
苯芴醇 (CAS 82186-77-4), with molecular formula C30H32Cl3NO and molecular weight 527.15 g/mol. IUPAC: 2-(dibutylamino)-1-[2,7-dichloro-9-[(4-chlorophenyl)methylidene]fluoren-4-yl]ethanol.
Chemical Property Profile of 苯芴醇
Property Insights of 苯芴醇
The XLogP value of 8.7 indicates that 苯芴醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.5 Ų, 苯芴醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 苯芴醇 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 苯芴醇?
The CAS number of 苯芴醇 is 82186-77-4.
What is the molecular formula of 苯芴醇?
The molecular formula of 苯芴醇 is C30H32Cl3NO.
What is the molecular weight of 苯芴醇?
The molecular weight of 苯芴醇 is 527.15 g/mol.
Where can I buy 苯芴醇?
You can request a quote for 苯芴醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苯芴醇?
Yes, KEHONG BIO provides custom synthesis services for 苯芴醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.