![1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione structure](/static/products/5792/5792-93-8.webp)
1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione
TL;DR: 1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione (CAS 5792-93-8) is a chemical compound with molecular formula C8H12N4O2 and molecular weight 196.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,9,10,12-tetrazatricyclo[4.3.3.01,6]dodecane-8,11-dione
Also Known As: J1.654.914B, J2.044.083J, A3478/0147529, tetrahydro-1H-3a,7a-(epiminomethanoimino)benzo[d]imidazole-2,9(3H)-dione, 1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione
| Molecular Formula | C8H12N4O2 |
|---|---|
| Molecular Weight | 196.10 g/mol |
| LogP | -0.4214 |
| Topological Polar Surface Area | 82.26 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 196.09602 |
| Heavy Atoms | 14 |
| Complexity | 279.30298 |
Chemical Identifiers
| CAS Number | 5792-93-8 |
|---|---|
| SMILES | C1CCC23C(C1)(NC(=O)N2)NC(=O)N3 |
Product Overview
1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione (CAS 5792-93-8), with molecular formula C8H12N4O2 and molecular weight 196.10 g/mol. IUPAC: 7,9,10,12-tetrazatricyclo[4.3.3.01,6]dodecane-8,11-dione.
Chemical Property Profile of 1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione
Property Insights of 1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione
The XLogP value of -0.4214 indicates that 1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 82.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione. Following Lipinski's Rule of Five, 1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione has 4 hydrogen bond donor(s) and 2 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 1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione?
The CAS number of 1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione is 5792-93-8.
What is the molecular formula of 1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione?
The molecular formula of 1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione is C8H12N4O2.
What is the molecular weight of 1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione?
The molecular weight of 1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione is 196.10 g/mol.
Where can I buy 1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione?
You can request a quote for 1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 1H,4H-3a,6a-Butanoimidazo[4,5-d]imidazole-2,5(3H,6H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.