1,4,5,6-Tetrahydropyrimidine
TL;DR: 1,4,5,6-Tetrahydropyrimidine (CAS 38115-29-6) is a chemical compound with molecular formula C1CNC=NC1 and molecular weight 84.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4,5,6-tetrahydropyrimidine
Also Known As: 1,4,5,6-Tetrahydropyrimidine, 1,3-Diazacyclohexene, Pyrimidine, 1,4,5,6-tetrahydro-, 1456-Tetrahydropyrimidine, 3,4,5,6-tetrahydropyrimidine
| Molecular Formula | C1CNC=NC1 |
|---|---|
| Molecular Weight | 84.07 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 24.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 84.06875 |
| Heavy Atoms | 6 |
| Complexity | 58.0 |
Chemical Identifiers
| CAS Number | 38115-29-6 |
|---|---|
| SMILES | C1CNC=NC1 |
| InChIKey | VBXZSFNZVNDOPB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4,5,6-Tetrahydropyrimidine (CAS 38115-29-6), with molecular formula C1CNC=NC1 and molecular weight 84.07 g/mol. IUPAC: 1,4,5,6-tetrahydropyrimidine.
Chemical Property Profile of 1,4,5,6-Tetrahydropyrimidine
Property Insights of 1,4,5,6-Tetrahydropyrimidine
The XLogP value of -0.4 indicates that 1,4,5,6-Tetrahydropyrimidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 24.4 Ų, 1,4,5,6-Tetrahydropyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 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 1,4,5,6-Tetrahydropyrimidine?
The CAS number of 1,4,5,6-Tetrahydropyrimidine is 38115-29-6.
What is the molecular formula of 1,4,5,6-Tetrahydropyrimidine?
The molecular formula of 1,4,5,6-Tetrahydropyrimidine is C1CNC=NC1.
What is the molecular weight of 1,4,5,6-Tetrahydropyrimidine?
The molecular weight of 1,4,5,6-Tetrahydropyrimidine is 84.07 g/mol.
Where can I buy 1,4,5,6-Tetrahydropyrimidine?
You can request a quote for 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 1,4,5,6-Tetrahydropyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 1,4,5,6-Tetrahydropyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.