血根碱
TL;DR: 血根碱 (CAS 2447-54-3) is a chemical compound with molecular formula C20H14NO4+ and molecular weight 332.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
血根碱
24-methyl-5,7,18,20-tetraoxa-24-azoniahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(24),2,4(8),9,11,13,15,17(21),22-nonaene
Also Known As: SANGUINARINE, Pseudochelerythrine, Sanguinarin, sangvinarin, Sanguiritrin
| Molecular Formula | C20H14NO4+ |
|---|---|
| Molecular Weight | 332.09 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 40.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 332.0923 |
| Heavy Atoms | 25 |
| Complexity | 530.0 |
| Melting Point | 266 °C |
Chemical Identifiers
| CAS Number | 2447-54-3 |
|---|---|
| SMILES | C[N+]1=C2C(=C3C=CC4=C(C3=C1)OCO4)C=CC5=CC6=C(C=C52)OCO6 |
| InChIKey | INVGWHRKADIJHF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
血根碱 (CAS 2447-54-3), with molecular formula C20H14NO4+ and molecular weight 332.09 g/mol. IUPAC: 24-methyl-5,7,18,20-tetraoxa-24-azoniahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(24),2,4(8),9,11,13,15,17(21),22-nonaene.
Chemical Property Profile of 血根碱
Property Insights of 血根碱
The XLogP value of 4.4 indicates that 血根碱 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.8 Ų, 血根碱 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 血根碱 has 0 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 血根碱?
The CAS number of 血根碱 is 2447-54-3.
What is the molecular formula of 血根碱?
The molecular formula of 血根碱 is C20H14NO4+.
What is the molecular weight of 血根碱?
The molecular weight of 血根碱 is 332.09 g/mol.
Where can I buy 血根碱?
You can request a quote for 血根碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 血根碱?
Yes, KEHONG BIO provides custom synthesis services for 血根碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.