CTK1D6301
TL;DR: CTK1D6301 (CAS 40790-11-2) is a chemical compound with molecular formula C21H30O5 and molecular weight 362.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8,16,18-trimethoxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),12,15,17-tetraen-2-one
Also Known As: 11,12-Dehydrozearalanol 7,14,16-trimethyl ether, 3,4,5,6,7,8,9,10-Octahydro-7,14,16-trimethoxy-3-methyl-1H-2-benzoxacyclotetradecin-1-one
| Molecular Formula | C21H30O5 |
|---|---|
| Molecular Weight | 362.21 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.20932 |
| Heavy Atoms | 26 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 40790-11-2 |
|---|---|
| SMILES | CC1CCCC(CCCC=CC2=C(C(=CC(=C2)OC)OC)C(=O)O1)OC |
| InChIKey | LYQNWEHJZOZNLY-UHFFFAOYSA-N |
Product Overview
CTK1D6301 (CAS 40790-11-2), with molecular formula C21H30O5 and molecular weight 362.21 g/mol. IUPAC: 8,16,18-trimethoxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),12,15,17-tetraen-2-one.
Chemical Property Profile of CTK1D6301
Property Insights of CTK1D6301
The XLogP value of 4.7 indicates that CTK1D6301 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, CTK1D6301 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CTK1D6301 has 0 hydrogen bond donor(s) and 5 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 CTK1D6301?
The CAS number of CTK1D6301 is 40790-11-2.
What is the molecular formula of CTK1D6301?
The molecular formula of CTK1D6301 is C21H30O5.
What is the molecular weight of CTK1D6301?
The molecular weight of CTK1D6301 is 362.21 g/mol.
Where can I buy CTK1D6301?
You can request a quote for CTK1D6301 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK1D6301?
Yes, KEHONG BIO provides custom synthesis services for CTK1D6301 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.