2-Phenyl-1,4,5,6-tetrahydropyrimidine
TL;DR: 2-Phenyl-1,4,5,6-tetrahydropyrimidine (CAS 5417-73-2) is a chemical compound with molecular formula C10H12N2 and molecular weight 160.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenyl-1,4,5,6-tetrahydropyrimidine
Also Known As: 2-phenyl-1,4,5,6-tetrahydropyrimidine, Pyrimidine, 1,4,5,6-tetrahydro-2-phenyl-, N1,N2-(Trimethylene)benzamidine, 2-Phenyl-1,4,5,6-tetrahydro-pyrimidine, 2-Phenyl-3,4,5,6-tetrahydropyrimidine
| Molecular Formula | C10H12N2 |
|---|---|
| Molecular Weight | 160.10 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 24.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.10005 |
| Heavy Atoms | 12 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 5417-73-2 |
|---|---|
| SMILES | C1CNC(=NC1)C2=CC=CC=C2 |
| InChIKey | MNLNQEMXGZMOEI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Phenyl-1,4,5,6-tetrahydropyrimidine (CAS 5417-73-2), with molecular formula C10H12N2 and molecular weight 160.10 g/mol. IUPAC: 2-phenyl-1,4,5,6-tetrahydropyrimidine.
Chemical Property Profile of 2-Phenyl-1,4,5,6-tetrahydropyrimidine
Property Insights of 2-Phenyl-1,4,5,6-tetrahydropyrimidine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Phenyl-1,4,5,6-tetrahydropyrimidine. With a topological polar surface area (TPSA) of 24.4 Ų, 2-Phenyl-1,4,5,6-tetrahydropyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenyl-1,4,5,6-tetrahydropyrimidine has 1 hydrogen bond donor(s) and 1 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-Phenyl-1,4,5,6-tetrahydropyrimidine?
The CAS number of 2-Phenyl-1,4,5,6-tetrahydropyrimidine is 5417-73-2.
What is the molecular formula of 2-Phenyl-1,4,5,6-tetrahydropyrimidine?
The molecular formula of 2-Phenyl-1,4,5,6-tetrahydropyrimidine is C10H12N2.
What is the molecular weight of 2-Phenyl-1,4,5,6-tetrahydropyrimidine?
The molecular weight of 2-Phenyl-1,4,5,6-tetrahydropyrimidine is 160.10 g/mol.
Where can I buy 2-Phenyl-1,4,5,6-tetrahydropyrimidine?
You can request a quote for 2-Phenyl-1,4,5,6-tetrahydropyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phenyl-1,4,5,6-tetrahydropyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenyl-1,4,5,6-tetrahydropyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.