3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene
TL;DR: 3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene (CAS 55180-24-0) is a chemical compound with molecular formula C22H30O5 and molecular weight 374.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Also Known As: Bed-epoxyestrene, 3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene, (5alpha,10alpha)-5,10-Epoxyestr-9(11)-ene-3,17-dione cyclic bis(1,2-ethanediyl acetal), 3-Acetyl-5-p-fluorobenzylidene-2,5-dihydro-4-hydroxy-2-oxothiophen, (3'aS,3'bS,5'aR,9'aR,11'aS)-11'a-Methyl-2',3',3'a,3'b,4',5',8',9',11',11'a-decahydro-6'H-dispiro[[1,3]dioxolane-2,1'-[5a,9a]epoxycyclopenta[a]phenanthrene-7',2''-[1,3]dioxolane]
| Molecular Formula | C22H30O5 |
|---|---|
| Molecular Weight | 374.21 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 49.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 374.20932 |
| Heavy Atoms | 27 |
| Complexity | 720.0 |
Chemical Identifiers
| CAS Number | 55180-24-0 |
|---|---|
| SMILES | C[C@]12CC=C3[C@H]([C@@H]1CCC24OCCO4)CC[C@@]56[C@@]3(O5)CCC7(C6)OCCO7 |
| InChIKey | ZFJGUFKEIAMGEH-XJEZRWEYSA-N |
Product Overview
3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene (CAS 55180-24-0), with molecular formula C22H30O5 and molecular weight 374.21 g/mol.
Chemical Property Profile of 3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene
Property Insights of 3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene. With a topological polar surface area (TPSA) of 49.5 Ų, 3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene 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 3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene?
The CAS number of 3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene is 55180-24-0.
What is the molecular formula of 3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene?
The molecular formula of 3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene is C22H30O5.
What is the molecular weight of 3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene?
The molecular weight of 3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene is 374.21 g/mol.
Where can I buy 3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene?
You can request a quote for 3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene?
Yes, KEHONG BIO provides custom synthesis services for 3,3,17,17-Bis(ethylenedioxy)-5,10-oxidoestr-9(11)-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.