2,4,6-Triprenyl-phenol
TL;DR: 2,4,6-Triprenyl-phenol (CAS 568543-67-9) is a chemical compound with molecular formula C12H11N3OS and molecular weight 245.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)acetonitrile
Also Known As: 2,4,6-Triprenyl-phenol, (4-Oxo-3,4,5,6,7,8-hexahydro-benzo[4,5]thieno[2,3-d]pyrimidin-2-yl)-acetonitrile, IDI1_007739, 1,4,5,6,7,8-Hexahydro-4-oxo[1]benzothieno[2,3-d]pyrimidine-2-acetonitrile, J2.578.049C
| Molecular Formula | C12H11N3OS |
|---|---|
| Molecular Weight | 245.06 g/mol |
| LogP | 1.92948 |
| Topological Polar Surface Area | 69.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 245.06229 |
| Heavy Atoms | 17 |
| Complexity | 677.3412 |
Chemical Identifiers
| CAS Number | 568543-67-9 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)CC#N |
Product Overview
2,4,6-Triprenyl-phenol (CAS 568543-67-9), with molecular formula C12H11N3OS and molecular weight 245.06 g/mol. IUPAC: 2-(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)acetonitrile.
Chemical Property Profile of 2,4,6-Triprenyl-phenol
Property Insights of 2,4,6-Triprenyl-phenol
The XLogP value of 1.92948 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,6-Triprenyl-phenol. The TPSA of 69.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4,6-Triprenyl-phenol. Following Lipinski's Rule of Five, 2,4,6-Triprenyl-phenol has 1 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 2,4,6-Triprenyl-phenol?
The CAS number of 2,4,6-Triprenyl-phenol is 568543-67-9.
What is the molecular formula of 2,4,6-Triprenyl-phenol?
The molecular formula of 2,4,6-Triprenyl-phenol is C12H11N3OS.
What is the molecular weight of 2,4,6-Triprenyl-phenol?
The molecular weight of 2,4,6-Triprenyl-phenol is 245.06 g/mol.
Where can I buy 2,4,6-Triprenyl-phenol?
You can request a quote for 2,4,6-Triprenyl-phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-Triprenyl-phenol?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Triprenyl-phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.