1,4,5,6-Tetrahydro-5-phenoxypyrimidine
TL;DR: 1,4,5,6-Tetrahydro-5-phenoxypyrimidine (CAS 36860-49-8) is a chemical compound with molecular formula C10H12N2O and molecular weight 176.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenoxy-1,4,5,6-tetrahydropyrimidine
Also Known As: 1,4,5,6-Tetrahydro-5-phenoxypyrimidine, 5-phenoxy-1,4,5,6-tetrahydropyrimidine, Pyrimidine, 1,4,5,6-tetrahydro-5-phenoxy-, 1,4,5,6-tetrahydro-5-phenoxy pyrimidine, Pyrimidine,1,4,5,6-tetrahydro-5-phenoxy-
| Molecular Formula | C10H12N2O |
|---|---|
| Molecular Weight | 176.09 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 33.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.09496 |
| Heavy Atoms | 13 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 36860-49-8 |
|---|---|
| SMILES | C1C(CN=CN1)OC2=CC=CC=C2 |
| InChIKey | OIGIQMJAAZXDQH-UHFFFAOYSA-N |
Product Overview
1,4,5,6-Tetrahydro-5-phenoxypyrimidine (CAS 36860-49-8), with molecular formula C10H12N2O and molecular weight 176.09 g/mol. IUPAC: 5-phenoxy-1,4,5,6-tetrahydropyrimidine.
Chemical Property Profile of 1,4,5,6-Tetrahydro-5-phenoxypyrimidine
Property Insights of 1,4,5,6-Tetrahydro-5-phenoxypyrimidine
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4,5,6-Tetrahydro-5-phenoxypyrimidine. With a topological polar surface area (TPSA) of 33.6 Ų, 1,4,5,6-Tetrahydro-5-phenoxypyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4,5,6-Tetrahydro-5-phenoxypyrimidine has 1 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 1,4,5,6-Tetrahydro-5-phenoxypyrimidine?
The CAS number of 1,4,5,6-Tetrahydro-5-phenoxypyrimidine is 36860-49-8.
What is the molecular formula of 1,4,5,6-Tetrahydro-5-phenoxypyrimidine?
The molecular formula of 1,4,5,6-Tetrahydro-5-phenoxypyrimidine is C10H12N2O.
What is the molecular weight of 1,4,5,6-Tetrahydro-5-phenoxypyrimidine?
The molecular weight of 1,4,5,6-Tetrahydro-5-phenoxypyrimidine is 176.09 g/mol.
Where can I buy 1,4,5,6-Tetrahydro-5-phenoxypyrimidine?
You can request a quote for 1,4,5,6-Tetrahydro-5-phenoxypyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4,5,6-Tetrahydro-5-phenoxypyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 1,4,5,6-Tetrahydro-5-phenoxypyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.