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1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione structure
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1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione

TL;DR: 1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione (CAS 132611-25-7) is a chemical compound with molecular formula C5H5N5O2 and molecular weight 167.04433 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1,4,6,7-tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione

Also Known As: J1.843.731G, 1,4,6,7-tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione, 4H,6H,7H-Imidazo[4,5-e]1,2,4-triazepine-5,8-dione, 3,4-Dihydroimidazo[4,5-e][1,2,4]triazepine-5,8(6H,7H)-dione, 3H,4H,5H,6H,7H,8H-imidazo[4,5-e][1,2,4]triazepine-5,8-dione

CAS Number
132611-25-7
Molecular Formula
C5H5N5O2
Molecular Weight
167.04433 g/mol
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Technical Specifications

Molecular FormulaC5H5N5O2
Molecular Weight167.04433 g/mol
XLogP-1.0
Topological Polar Surface Area (TPSA)98.9 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors3
Rotatable Bonds0
Exact Mass167.04433 Da
Heavy Atoms12
Complexity230.0
SMILESC1=NC2=C(N1)C(=O)NNC(=O)N2
InChIKeyCFDSAXCIZZLOQJ-UHFFFAOYSA-N

Chemical Property Profile of 1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione

XLogP
-1.0
TPSA (Topological Polar Surface Area)
98.9
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
3
Rotatable Bonds
0
Heavy Atoms
12
Complexity
230.0
Exact Mass
167.04433
Monoisotopic Mass
167.04433
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 1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione

The XLogP value of -1.0 indicates that 1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione. Following Lipinski's Rule of Five, 1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione has 4 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione?

The CAS number of 1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione is 132611-25-7.

What is the molecular formula of 1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione?

The molecular formula of 1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione is C5H5N5O2.

What is the molecular weight of 1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione?

The molecular weight of 1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione is 167.04433 g/mol.

Where can I buy 1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione?

You can request a quote for 1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione?

Yes, CoreyChem provides custom synthesis services for 1,4,6,7-Tetrahydroimidazo[4,5-e][1,2,4]triazepine-5,8-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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