1,3,5-Triaza-7-phosphaadamantane-P-selenide
TL;DR: 1,3,5-Triaza-7-phosphaadamantane-P-selenide (CAS 79568-42-6) is a chemical compound with molecular formula C6H12N3PSe and molecular weight 236.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-selanylidene-1,3,5-triaza-7λ5-phosphatricyclo[3.3.1.13,7]decane
Also Known As: 1,3,5-Triaza-7-phosphaadamantane-P-selenide, 1,3,5-Triaza-7lambda~5~-phosphatricyclo[3.3.1.1~3,7~]decane-7-selone, RefChem:217207
| Molecular Formula | C6H12N3PSe |
|---|---|
| Molecular Weight | 236.99 g/mol |
| LogP | -0.2207 |
| Topological Polar Surface Area | 9.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 236.99341 |
| Heavy Atoms | 11 |
| Complexity | 194.0 |
Chemical Identifiers
| CAS Number | 79568-42-6 |
|---|---|
| SMILES | C1N2CN3CN1CP(=[Se])(C2)C3 |
| InChIKey | HKHJSAJVKBJNAQ-UHFFFAOYSA-N |
Product Overview
1,3,5-Triaza-7-phosphaadamantane-P-selenide (CAS 79568-42-6), with molecular formula C6H12N3PSe and molecular weight 236.99 g/mol. IUPAC: 7-selanylidene-1,3,5-triaza-7λ5-phosphatricyclo[3.3.1.13,7]decane.
Chemical Property Profile of 1,3,5-Triaza-7-phosphaadamantane-P-selenide
Property Insights of 1,3,5-Triaza-7-phosphaadamantane-P-selenide
The XLogP value of -0.2207 indicates that 1,3,5-Triaza-7-phosphaadamantane-P-selenide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 9.7 Ų, 1,3,5-Triaza-7-phosphaadamantane-P-selenide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,5-Triaza-7-phosphaadamantane-P-selenide has 0 hydrogen bond donor(s) and 3 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-Triaza-7-phosphaadamantane-P-selenide?
The CAS number of 1,3,5-Triaza-7-phosphaadamantane-P-selenide is 79568-42-6.
What is the molecular formula of 1,3,5-Triaza-7-phosphaadamantane-P-selenide?
The molecular formula of 1,3,5-Triaza-7-phosphaadamantane-P-selenide is C6H12N3PSe.
What is the molecular weight of 1,3,5-Triaza-7-phosphaadamantane-P-selenide?
The molecular weight of 1,3,5-Triaza-7-phosphaadamantane-P-selenide is 236.99 g/mol.
Where can I buy 1,3,5-Triaza-7-phosphaadamantane-P-selenide?
You can request a quote for 1,3,5-Triaza-7-phosphaadamantane-P-selenide 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-Triaza-7-phosphaadamantane-P-selenide?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Triaza-7-phosphaadamantane-P-selenide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.