CTK1C2766
TL;DR: CTK1C2766 (CAS 39013-24-6) is a chemical compound with molecular formula C14H20O3 and molecular weight 236.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1-hydroxy-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-3-yl)but-3-en-2-one
Also Known As: 4-(1,4a,5,6,7,7a-Hexahydro-1-hydroxy-4,7-dimethylcyclopenta[c]pyran-3-yl)-3-buten-2-one, 3-Buten-2-one, 4-(1,4a,5,6,7,7a-hexahydro-1-hydroxy-4,7-dimethylcyclopenta(c)pyran-3-yl)-
| Molecular Formula | C14H20O3 |
|---|---|
| Molecular Weight | 236.14 g/mol |
| LogP | 2.4165 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.14125 |
| Heavy Atoms | 17 |
| Complexity | 380.92856 |
Chemical Identifiers
| CAS Number | 39013-24-6 |
|---|---|
| SMILES | CC1CCC2C1C(OC(=C2C)C=CC(=O)C)O |
Product Overview
CTK1C2766 (CAS 39013-24-6), with molecular formula C14H20O3 and molecular weight 236.14 g/mol. IUPAC: 4-(1-hydroxy-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-3-yl)but-3-en-2-one.
Chemical Property Profile of CTK1C2766
Property Insights of CTK1C2766
The XLogP value of 2.4165 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK1C2766. With a topological polar surface area (TPSA) of 46.53 Ų, CTK1C2766 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CTK1C2766 has 1 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 CTK1C2766?
The CAS number of CTK1C2766 is 39013-24-6.
What is the molecular formula of CTK1C2766?
The molecular formula of CTK1C2766 is C14H20O3.
What is the molecular weight of CTK1C2766?
The molecular weight of CTK1C2766 is 236.14 g/mol.
Where can I buy CTK1C2766?
You can request a quote for CTK1C2766 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK1C2766?
Yes, KEHONG BIO provides custom synthesis services for CTK1C2766 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.