![5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione structure](/static/products/866/866008-35-7.png)
5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione
TL;DR: 5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione (CAS 866008-35-7) is a chemical compound with molecular formula C22H14FNO2S2 and molecular weight 407.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-[(3-fluorophenyl)methylidene]-4,10-dithia-1-azatetracyclo[9.7.0.03,7.012,17]octadeca-3(7),5,12,14,16-pentaene-8,18-dione
Also Known As: 5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione, 9-[(3-fluorophenyl)methylidene]-4,10-dithia-1-azatetracyclo[9.7.0.0(3),?.0(1)(2),(1)?]octadeca-3(7),5,12(17),13,15-pentaene-8,18-dione
| Molecular Formula | C22H14FNO2S2 |
|---|---|
| Molecular Weight | 407.05 g/mol |
| LogP | 5.5124 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 407.045 |
| Heavy Atoms | 28 |
| Complexity | 1150.6984 |
Chemical Identifiers
| CAS Number | 866008-35-7 |
|---|---|
| SMILES | C1C2=C(C=CS2)C(=O)C(=CC3=CC(=CC=C3)F)SC4N1C(=O)C5=CC=CC=C45 |
Product Overview
5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione (CAS 866008-35-7), with molecular formula C22H14FNO2S2 and molecular weight 407.05 g/mol. IUPAC: 9-[(3-fluorophenyl)methylidene]-4,10-dithia-1-azatetracyclo[9.7.0.03,7.012,17]octadeca-3(7),5,12,14,16-pentaene-8,18-dione.
Chemical Property Profile of 5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione
Property Insights of 5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione
The XLogP value of 5.5124 indicates that 5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.38 Ų, 5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione?
The CAS number of 5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione is 866008-35-7.
What is the molecular formula of 5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione?
The molecular formula of 5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione is C22H14FNO2S2.
What is the molecular weight of 5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione?
The molecular weight of 5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione is 407.05 g/mol.
Where can I buy 5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione?
You can request a quote for 5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(Z)-(3-fluorophenyl)methylidene]-5H-thieno[2',3':5,6][1,3]thiazocino[2,3-a]isoindole-4,11(6aH,13H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.