1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine
TL;DR: 1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine (CAS 41378-98-7) is a chemical compound with molecular formula C12H20N4O4 and molecular weight 284.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,5,7-triacetyl-1,3,5,7-tetrazocan-1-yl)ethanone
Also Known As: EINECS 255-343-0, 1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine, 1,3,5,7-tetraacetyl-1,3,5,7-tetraazacyclooctane, 1-(3,5,7-triacetyl-1,3,5,7-tetrazocan-1-yl)ethanone, 1,3,5,7-Tetrazocine, 1,3,5,7-tetraacetyloctahydro-
| Molecular Formula | C12H20N4O4 |
|---|---|
| Molecular Weight | 284.15 g/mol |
| LogP | -0.776 |
| Topological Polar Surface Area | 81.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 284.14847 |
| Heavy Atoms | 20 |
| Complexity | 349.17325 |
Chemical Identifiers
| CAS Number | 41378-98-7 |
|---|---|
| SMILES | CC(=O)N1CN(CN(CN(C1)C(=O)C)C(=O)C)C(=O)C |
Product Overview
1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine (CAS 41378-98-7), with molecular formula C12H20N4O4 and molecular weight 284.15 g/mol. IUPAC: 1-(3,5,7-triacetyl-1,3,5,7-tetrazocan-1-yl)ethanone.
Chemical Property Profile of 1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine
Property Insights of 1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine
The XLogP value of -0.776 indicates that 1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 81.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine. Following Lipinski's Rule of Five, 1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine 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
Frequently Asked Questions
What is the CAS number of 1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine?
The CAS number of 1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine is 41378-98-7.
What is the molecular formula of 1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine?
The molecular formula of 1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine is C12H20N4O4.
What is the molecular weight of 1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine?
The molecular weight of 1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine is 284.15 g/mol.
Where can I buy 1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine?
You can request a quote for 1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5,7-Tetraacetyloctahydro-1,3,5,7-tetrazocine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.