2-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol
TL;DR: 2-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol (CAS 158982-15-1) is a chemical compound with molecular formula C17H22N6O and molecular weight 326.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[6-(benzylamino)-9-propan-2-ylpurin-2-yl]amino]ethanol
Also Known As: N9-Isopropylolomoucine, 9-Isopropylolomoucine, N9-ISOPROPYL-OLOMOUCINE, purine deriv. 4, N9-isopropylolomucine
| Molecular Formula | C17H22N6O |
|---|---|
| Molecular Weight | 326.19 g/mol |
| LogP | 2.4235 |
| Topological Polar Surface Area | 87.89 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 326.18552 |
| Heavy Atoms | 24 |
| Complexity | 799.4509 |
Chemical Identifiers
| CAS Number | 158982-15-1 |
|---|---|
| SMILES | CC(C)N1C=NC2=C(N=C(N=C21)NCCO)NCC3=CC=CC=C3 |
Product Overview
2-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol (CAS 158982-15-1), with molecular formula C17H22N6O and molecular weight 326.19 g/mol. IUPAC: 2-[[6-(benzylamino)-9-propan-2-ylpurin-2-yl]amino]ethanol.
Chemical Property Profile of 2-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol
Property Insights of 2-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol
The XLogP value of 2.4235 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol. The TPSA of 87.89 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol. Following Lipinski's Rule of Five, 2-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol has 3 hydrogen bond donor(s) and 6 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-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol?
The CAS number of 2-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol is 158982-15-1.
What is the molecular formula of 2-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol?
The molecular formula of 2-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol is C17H22N6O.
What is the molecular weight of 2-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol?
The molecular weight of 2-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol is 326.19 g/mol.
Where can I buy 2-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol?
You can request a quote for 2-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-((6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl)amino)ethan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.