6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine
TL;DR: 6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine (CAS 83285-96-5) is a chemical compound with molecular formula C12H15N5O and molecular weight 245.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(aziridin-1-yl)-9-(oxan-2-yl)purine
Also Known As: 6-(aziridin-1-yl)-9-(oxan-2-yl)purine, 6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine, 6-(Aziridin-1-yl)-9-(oxan-2-yl)-9H-purine, 6-aziridin-1-yl-9-tetrahydropyran-2-yl-9H-purine
| Molecular Formula | C12H15N5O |
|---|---|
| Molecular Weight | 245.13 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.12766 |
| Heavy Atoms | 18 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 83285-96-5 |
|---|---|
| SMILES | C1CCOC(C1)N2C=NC3=C2N=CN=C3N4CC4 |
| InChIKey | WLVKVDQENOQPSD-UHFFFAOYSA-N |
Product Overview
6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine (CAS 83285-96-5), with molecular formula C12H15N5O and molecular weight 245.13 g/mol. IUPAC: 6-(aziridin-1-yl)-9-(oxan-2-yl)purine.
Chemical Property Profile of 6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine
Property Insights of 6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine. With a topological polar surface area (TPSA) of 55.8 Ų, 6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine has 0 hydrogen bond donor(s) and 5 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 6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine?
The CAS number of 6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine is 83285-96-5.
What is the molecular formula of 6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine?
The molecular formula of 6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine is C12H15N5O.
What is the molecular weight of 6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine?
The molecular weight of 6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine is 245.13 g/mol.
Where can I buy 6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine?
You can request a quote for 6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine?
Yes, KEHONG BIO provides custom synthesis services for 6-(aziridin-1-yl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.