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2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione structure
Fine Chemical

2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione

TL;DR: 2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione (CAS 1166390-81-3) is a chemical compound with molecular formula C14H12N2O2S and molecular weight 272.06195 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-(1,3-thiazol-2-yl)-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-ene-3,5-dione

Also Known As: 2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione, 4-(1,3-thiazol-2-yl)-4-azatetracyclo[5.3.2.0~2,6~.0~8,10~]dodec-11-ene-3,5-dione, (3aR,4S,4aS,5aR,6R,6aS)-2-(thiazol-2-yl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione, 2-(thiazol-2-yl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione

CAS Number
1166390-81-3
Molecular Formula
C14H12N2O2S
Molecular Weight
272.06195 g/mol
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Technical Specifications

Molecular FormulaC14H12N2O2S
Molecular Weight272.06195 g/mol
XLogP1.5
Topological Polar Surface Area (TPSA)78.5 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds1
Exact Mass272.06195 Da
Heavy Atoms19
Complexity484.0
SMILESC1C2C1C3C=CC2C4C3C(=O)N(C4=O)C5=NC=CS5
InChIKeySJJBWGGLFGERET-UHFFFAOYSA-N

Chemical Property Profile of 2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione

XLogP
1.5
TPSA (Topological Polar Surface Area)
78.5
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
1
Heavy Atoms
19
Complexity
484.0
Exact Mass
272.06195
Monoisotopic Mass
272.06195
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione

The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione. Following Lipinski's Rule of Five, 2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione?

The CAS number of 2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione is 1166390-81-3.

What is the molecular formula of 2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione?

The molecular formula of 2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione is C14H12N2O2S.

What is the molecular weight of 2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione?

The molecular weight of 2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione is 272.06195 g/mol.

Where can I buy 2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione?

You can request a quote for 2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione?

Yes, CoreyChem provides custom synthesis services for 2-(1,3-thiazol-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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