3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin
TL;DR: 3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin (CAS 85850-84-6) is a chemical compound with molecular formula C26H24OS and molecular weight 384.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(11Z)-11-ethyl-12-phenyl-3-prop-2-enoxy-6H-benzo[c][1]benzothiocine
Also Known As: 3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin, 6H-DIBENZO(b,f)THIOCIN, 3-(ALLYLOXY)-11-ETHYL-12-PHENYL-, (11Z)-11-ethyl-12-phenyl-3-prop-2-enoxy-6H-benzo[c][1]benzothiocine, 6H-DIBENZO(B,F)THIOCIN, 11-ETHYL-12-PHENYL-3-(2-PROPEN-1-YLOXY)-, BRN 5621991
| Molecular Formula | C26H24OS |
|---|---|
| Molecular Weight | 384.15 g/mol |
| LogP | 7.2262 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.1548 |
| Heavy Atoms | 28 |
| Complexity | 1017.6126 |
Chemical Identifiers
| CAS Number | 85850-84-6 |
|---|---|
| SMILES | CC/C/1=C(/C2=C(C=C(C=C2)OCC=C)SCC3=CC=CC=C31)\C4=CC=CC=C4 |
Product Overview
3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin (CAS 85850-84-6), with molecular formula C26H24OS and molecular weight 384.15 g/mol. IUPAC: (11Z)-11-ethyl-12-phenyl-3-prop-2-enoxy-6H-benzo[c][1]benzothiocine.
Chemical Property Profile of 3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin
Property Insights of 3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin
The XLogP value of 7.2262 indicates that 3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin?
The CAS number of 3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin is 85850-84-6.
What is the molecular formula of 3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin?
The molecular formula of 3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin is C26H24OS.
What is the molecular weight of 3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin?
The molecular weight of 3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin is 384.15 g/mol.
Where can I buy 3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin?
You can request a quote for 3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin?
Yes, KEHONG BIO provides custom synthesis services for 3-(Allyloxy)-11-ethyl-12-phenyl-6H-dibenzo(b,f)thiocin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.