8-N-benzyl-7H-purine-6,8-diamine
TL;DR: 8-N-benzyl-7H-purine-6,8-diamine (CAS 127820-06-8) is a chemical compound with molecular formula C12H12N6 and molecular weight 240.11235 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-N-benzyl-7H-purine-6,8-diamine
Also Known As: 6-Amino-8-benzylamino-9H-purine, N'-benzyl-7H-purine-6,8-diamine, N8-benzyl-9H-purine-6,8-diamine, 8-N-benzyl-7H-purine-6,8-diamine, 9H-Purine-6,8-diamine, N8-(phenylmethyl)-
Technical Specifications
| Molecular Formula | C12H12N6 |
| Molecular Weight | 240.11235 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 92.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.11235 Da |
| Heavy Atoms | 18 |
| Complexity | 267.0 |
| SMILES | C1=CC=C(C=C1)CNC2=NC3=NC=NC(=C3N2)N |
| InChIKey | VSQWABCZDXEESX-UHFFFAOYSA-N |
Chemical Property Profile of 8-N-benzyl-7H-purine-6,8-diamine
Property Insights of 8-N-benzyl-7H-purine-6,8-diamine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-N-benzyl-7H-purine-6,8-diamine. The TPSA of 92.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-N-benzyl-7H-purine-6,8-diamine. Following Lipinski's Rule of Five, 8-N-benzyl-7H-purine-6,8-diamine has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 8-N-benzyl-7H-purine-6,8-diamine?
The CAS number of 8-N-benzyl-7H-purine-6,8-diamine is 127820-06-8.
What is the molecular formula of 8-N-benzyl-7H-purine-6,8-diamine?
The molecular formula of 8-N-benzyl-7H-purine-6,8-diamine is C12H12N6.
What is the molecular weight of 8-N-benzyl-7H-purine-6,8-diamine?
The molecular weight of 8-N-benzyl-7H-purine-6,8-diamine is 240.11235 g/mol.
Where can I buy 8-N-benzyl-7H-purine-6,8-diamine?
You can request a quote for 8-N-benzyl-7H-purine-6,8-diamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 8-N-benzyl-7H-purine-6,8-diamine?
Yes, CoreyChem provides custom synthesis services for 8-N-benzyl-7H-purine-6,8-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.