地塞米诺
TL;DR: 地塞米诺 (CAS 112924-45-5) is a chemical compound with molecular formula C25H38O3 and molecular weight 386.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
地塞米诺
(6aS,10aS)-9-(hydroxymethyl)-6,6-dimethyl-3-(2-methyloctan-2-yl)-6a,7,10,10a-tetrahydrobenzo[c]chromen-1-ol
Also Known As: Dexanabinol, Sinnabidiol, Sinnabidol, HU 211, 11-OH-delta(8)-Thc-dmh
| Molecular Formula | C25H38O3 |
|---|---|
| Molecular Weight | 386.28 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 386.2821 |
| Heavy Atoms | 28 |
| Complexity | 550.0 |
Chemical Identifiers
| CAS Number | 112924-45-5 |
|---|---|
| SMILES | CCCCCCC(C)(C)C1=CC(=C2[C@H]3CC(=CC[C@@H]3C(OC2=C1)(C)C)CO)O |
| InChIKey | SSQJFGMEZBFMNV-PMACEKPBSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
地塞米诺 (CAS 112924-45-5), with molecular formula C25H38O3 and molecular weight 386.28 g/mol. IUPAC: (6aS,10aS)-9-(hydroxymethyl)-6,6-dimethyl-3-(2-methyloctan-2-yl)-6a,7,10,10a-tetrahydrobenzo[c]chromen-1-ol.
Chemical Property Profile of 地塞米诺
Property Insights of 地塞米诺
The XLogP value of 6.4 indicates that 地塞米诺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.7 Ų, 地塞米诺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 地塞米诺 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 地塞米诺?
The CAS number of 地塞米诺 is 112924-45-5.
What is the molecular formula of 地塞米诺?
The molecular formula of 地塞米诺 is C25H38O3.
What is the molecular weight of 地塞米诺?
The molecular weight of 地塞米诺 is 386.28 g/mol.
Where can I buy 地塞米诺?
You can request a quote for 地塞米诺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 地塞米诺?
Yes, KEHONG BIO provides custom synthesis services for 地塞米诺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.