Isochelidonine
TL;DR: Isochelidonine (CAS 142741-30-8) is a chemical compound with molecular formula C20H19NO5 and molecular weight 353.1263 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(13S)-12-methyl-5,7,17,19-tetraoxa-12-azahexacyclo[11.11.0.02,10.04,8.014,22.016,20]tetracosa-2,4(8),9,14,16(20),21-hexaen-24-ol
Also Known As: Isochelidonine, Isochelidonin, (+)-Isochelidonine, 1,3-Benzodioxolo(5,6-c)(1,3)dioxolo(4,5-j)phenanthridin-12-ol, 4b,5,6,11b,12,13-hexahydro-5-methyl-, (4bS-(4balpha,11balpha,12beta))-, (13S)-12-methyl-5,7,17,19-tetraoxa-12-azahexacyclo(11.11.0.02,10.04,8.014,22.016,20)tetracosa-2,4(8),9,14,16(20),21-hexaen-24-ol
Technical Specifications
| Molecular Formula | C20H19NO5 |
| Molecular Weight | 353.1263 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 60.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 353.1263 Da |
| Heavy Atoms | 26 |
| Complexity | 560.0 |
| SMILES | CN1CC2=CC3=C(C=C2C4[C@H]1C5=CC6=C(C=C5CC4O)OCO6)OCO3 |
| InChIKey | UBPAYYJTLBZPSD-OJISFJIHSA-N |
Chemical Property Profile of Isochelidonine
Property Insights of Isochelidonine
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isochelidonine. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Isochelidonine. Following Lipinski's Rule of Five, Isochelidonine has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Isochelidonine?
The CAS number of Isochelidonine is 142741-30-8.
What is the molecular formula of Isochelidonine?
The molecular formula of Isochelidonine is C20H19NO5.
What is the molecular weight of Isochelidonine?
The molecular weight of Isochelidonine is 353.1263 g/mol.
Where can I buy Isochelidonine?
You can request a quote for Isochelidonine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isochelidonine?
Yes, CoreyChem provides custom synthesis services for Isochelidonine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.