粉防己碱
TL;DR: 粉防己碱 (CAS 518-34-3) is a chemical compound with molecular formula C38H42N2O6 and molecular weight 622.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
粉防己碱
(1S,14S)-9,20,21,25-tetramethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaene
Also Known As: tetrandrine, D-Tetrandrine, (+)-Tetrandrine, Tetrandrin, Fanchinine
| Molecular Formula | C38H42N2O6 |
|---|---|
| Molecular Weight | 622.30 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 61.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 622.30426 |
| Heavy Atoms | 46 |
| Complexity | 979.0 |
Chemical Identifiers
| CAS Number | 518-34-3 |
|---|---|
| SMILES | CN1CCC2=CC(=C3C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)C[C@H]6C7=C(O3)C(=C(C=C7CCN6C)OC)OC)OC)OC |
| InChIKey | WVTKBKWTSCPRNU-KYJUHHDHSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
粉防己碱 (CAS 518-34-3), with molecular formula C38H42N2O6 and molecular weight 622.30 g/mol. IUPAC: (1S,14S)-9,20,21,25-tetramethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaene.
Chemical Property Profile of 粉防己碱
Property Insights of 粉防己碱
The XLogP value of 6.4 indicates that 粉防己碱 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 粉防己碱. Following Lipinski's Rule of Five, 粉防己碱 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 粉防己碱?
The CAS number of 粉防己碱 is 518-34-3.
What is the molecular formula of 粉防己碱?
The molecular formula of 粉防己碱 is C38H42N2O6.
What is the molecular weight of 粉防己碱?
The molecular weight of 粉防己碱 is 622.30 g/mol.
Where can I buy 粉防己碱?
You can request a quote for 粉防己碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 粉防己碱?
Yes, KEHONG BIO provides custom synthesis services for 粉防己碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.