Adenine, 7,8-dihydro-N-benzyl-
TL;DR: Adenine, 7,8-dihydro-N-benzyl- (CAS 102366-79-0) is a chemical compound with molecular formula C12H13N5 and molecular weight 227.1171 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-benzyl-8,9-dihydro-7H-purin-6-amine
Also Known As: 7,8-Dihydro-N-benzyladenine, ADENINE, 7,8-DIHYDRO-N-BENZYL-, N-benzyl-8,9-dihydro-7H-purin-6-amine, N-Benzyl-9H-purin-6-amine, ADENINE,7,8-DIHYDRO-N-BENZYL
Technical Specifications
| Molecular Formula | C12H13N5 |
| Molecular Weight | 227.1171 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 61.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.1171 Da |
| Heavy Atoms | 17 |
| Complexity | 241.0 |
| SMILES | C1NC2=C(N1)N=CN=C2NCC3=CC=CC=C3 |
| InChIKey | VCFTZBXEGUKNCA-UHFFFAOYSA-N |
Chemical Property Profile of Adenine, 7,8-dihydro-N-benzyl-
Property Insights of Adenine, 7,8-dihydro-N-benzyl-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Adenine, 7,8-dihydro-N-benzyl-. The TPSA of 61.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Adenine, 7,8-dihydro-N-benzyl-. Following Lipinski's Rule of Five, Adenine, 7,8-dihydro-N-benzyl- 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 Adenine, 7,8-dihydro-N-benzyl-?
The CAS number of Adenine, 7,8-dihydro-N-benzyl- is 102366-79-0.
What is the molecular formula of Adenine, 7,8-dihydro-N-benzyl-?
The molecular formula of Adenine, 7,8-dihydro-N-benzyl- is C12H13N5.
What is the molecular weight of Adenine, 7,8-dihydro-N-benzyl-?
The molecular weight of Adenine, 7,8-dihydro-N-benzyl- is 227.1171 g/mol.
Where can I buy Adenine, 7,8-dihydro-N-benzyl-?
You can request a quote for Adenine, 7,8-dihydro-N-benzyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Adenine, 7,8-dihydro-N-benzyl-?
Yes, CoreyChem provides custom synthesis services for Adenine, 7,8-dihydro-N-benzyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.