N6-Benzyl-5'-N-ethylcarboxamidoadenosine
TL;DR: N6-Benzyl-5'-N-ethylcarboxamidoadenosine (CAS 152918-32-6) is a chemical compound with molecular formula C19H22N6O4 and molecular weight 398.17026 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[6-(benzylamino)purin-9-yl]-N-ethyl-3,4-dihydroxyoxolane-2-carboxamide
Also Known As: N6-Benzyl-NECA, Lopac0_000236, PDSP1_000830, PDSP2_000817, N6-Benzyl-5'-N-ethylcarboxamidoadenosine
Technical Specifications
| Molecular Formula | C19H22N6O4 |
| Molecular Weight | 398.17026 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 134.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.17026 Da |
| Heavy Atoms | 29 |
| Complexity | 563.0 |
| SMILES | CCNC(=O)C1C(C(C(O1)N2C=NC3=C(N=CN=C32)NCC4=CC=CC=C4)O)O |
| InChIKey | VVHDYJFDZYHAMR-UHFFFAOYSA-N |
Chemical Property Profile of N6-Benzyl-5'-N-ethylcarboxamidoadenosine
Property Insights of N6-Benzyl-5'-N-ethylcarboxamidoadenosine
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N6-Benzyl-5'-N-ethylcarboxamidoadenosine. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N6-Benzyl-5'-N-ethylcarboxamidoadenosine. Following Lipinski's Rule of Five, N6-Benzyl-5'-N-ethylcarboxamidoadenosine has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N6-Benzyl-5'-N-ethylcarboxamidoadenosine?
The CAS number of N6-Benzyl-5'-N-ethylcarboxamidoadenosine is 152918-32-6.
What is the molecular formula of N6-Benzyl-5'-N-ethylcarboxamidoadenosine?
The molecular formula of N6-Benzyl-5'-N-ethylcarboxamidoadenosine is C19H22N6O4.
What is the molecular weight of N6-Benzyl-5'-N-ethylcarboxamidoadenosine?
The molecular weight of N6-Benzyl-5'-N-ethylcarboxamidoadenosine is 398.17026 g/mol.
Where can I buy N6-Benzyl-5'-N-ethylcarboxamidoadenosine?
You can request a quote for N6-Benzyl-5'-N-ethylcarboxamidoadenosine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N6-Benzyl-5'-N-ethylcarboxamidoadenosine?
Yes, CoreyChem provides custom synthesis services for N6-Benzyl-5'-N-ethylcarboxamidoadenosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.