Isocryptotanshinone
TL;DR: Isocryptotanshinone (CAS 22550-15-8) is a chemical compound with molecular formula C19H20O3 and molecular weight 296.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,8-trimethyl-2,3,8,9-tetrahydro-1H-naphtho[2,1-f][1]benzofuran-7,11-dione
Also Known As: Isocryptotanshinone, Isocryptotanshinon, isocryptotanshinone I, isocryptotanshinone II, J1.233.964J
| Molecular Formula | C19H20O3 |
|---|---|
| Molecular Weight | 296.14 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 296.14124 |
| Heavy Atoms | 22 |
| Complexity | 571.0 |
Chemical Identifiers
| CAS Number | 22550-15-8 |
|---|---|
| SMILES | CC1COC2=C1C(=O)C3=C(C2=O)C4=C(C=C3)C(CCC4)(C)C |
| InChIKey | VUIHARLRBGHPEA-UHFFFAOYSA-N |
Product Overview
Isocryptotanshinone (CAS 22550-15-8), with molecular formula C19H20O3 and molecular weight 296.14 g/mol. IUPAC: 4,4,8-trimethyl-2,3,8,9-tetrahydro-1H-naphtho[2,1-f][1]benzofuran-7,11-dione.
Chemical Property Profile of Isocryptotanshinone
Property Insights of Isocryptotanshinone
The XLogP value of 4.3 indicates that Isocryptotanshinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, Isocryptotanshinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isocryptotanshinone has 0 hydrogen bond donor(s) and 3 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 Isocryptotanshinone?
The CAS number of Isocryptotanshinone is 22550-15-8.
What is the molecular formula of Isocryptotanshinone?
The molecular formula of Isocryptotanshinone is C19H20O3.
What is the molecular weight of Isocryptotanshinone?
The molecular weight of Isocryptotanshinone is 296.14 g/mol.
Where can I buy Isocryptotanshinone?
You can request a quote for Isocryptotanshinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isocryptotanshinone?
Yes, KEHONG BIO provides custom synthesis services for Isocryptotanshinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.