Tei 3313
TL;DR: Tei 3313 (CAS 127282-17-1) is a chemical compound with molecular formula C23H30O5S and molecular weight 418.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(E)-4,7-dihydroxyhept-2-enylidene]-4-hydroxy-2-methylsulfanyl-4-(4-phenoxybutyl)cyclopent-2-en-1-one
Also Known As: Tei 3313, 2-Cyclopenten-1-one, 5-(4,7-dihydroxy-2-heptenylidene)-4-hydroxy-2-(methylthio)-4-(4-phenoxybutyl)-, (5E)-5-[(E)-4,7-dihydroxyhept-2-enylidene]-4-hydroxy-2-methylsulfanyl-4-(4-phenoxybutyl)cyclopent-2-en-1-one, 5-(4,7-Dihydroxy-2-heptenyridene)-4-hydroxy-2-methylthio-4-(4-phenoxybutyl)-2-cyclopentenone, RefChem:187719
| Molecular Formula | C23H30O5S |
|---|---|
| Molecular Weight | 418.18 g/mol |
| LogP | 3.4124 |
| Topological Polar Surface Area | 86.99 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 418.1814 |
| Heavy Atoms | 29 |
| Complexity | 740.8949 |
Chemical Identifiers
| CAS Number | 127282-17-1 |
|---|---|
| SMILES | CSC1=CC(/C(=C\C=C\C(CCCO)O)/C1=O)(CCCCOC2=CC=CC=C2)O |
Product Overview
Tei 3313 (CAS 127282-17-1), with molecular formula C23H30O5S and molecular weight 418.18 g/mol. IUPAC: (5E)-5-[(E)-4,7-dihydroxyhept-2-enylidene]-4-hydroxy-2-methylsulfanyl-4-(4-phenoxybutyl)cyclopent-2-en-1-one.
Chemical Property Profile of Tei 3313
Property Insights of Tei 3313
The XLogP value of 3.4124 indicates that Tei 3313 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.99 Ų falls within the moderate polarity range, balancing permeability and solubility for Tei 3313. Following Lipinski's Rule of Five, Tei 3313 has 3 hydrogen bond donor(s) and 6 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 Tei 3313?
The CAS number of Tei 3313 is 127282-17-1.
What is the molecular formula of Tei 3313?
The molecular formula of Tei 3313 is C23H30O5S.
What is the molecular weight of Tei 3313?
The molecular weight of Tei 3313 is 418.18 g/mol.
Where can I buy Tei 3313?
You can request a quote for Tei 3313 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tei 3313?
Yes, KEHONG BIO provides custom synthesis services for Tei 3313 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.