5'-(N-Methylcarboxamido)-N(6)-benzyladenosine
TL;DR: 5'-(N-Methylcarboxamido)-N(6)-benzyladenosine (CAS 152918-15-5) is a chemical compound with molecular formula C18H20N6O4 and molecular weight 384.1546 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3S,4R,5R)-5-[6-(benzylamino)purin-9-yl]-3,4-dihydroxy-N-methyloxolane-2-carboxamide
Also Known As: 5'-Nmc-N(6)-bzad, 5'-(N-Methylcarboxamido)-N(6)-benzyladenosine, N(6)-Benzyladenosine-5'-N-methyluronamide, PDSP1_000833, PDSP2_000820
Technical Specifications
| Molecular Formula | C18H20N6O4 |
| Molecular Weight | 384.1546 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 134.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.1546 Da |
| Heavy Atoms | 28 |
| Complexity | 548.0 |
| SMILES | CNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)NCC4=CC=CC=C4)O)O |
| InChIKey | XZQKRHODUKHITR-MOROJQBDSA-N |
Chemical Property Profile of 5'-(N-Methylcarboxamido)-N(6)-benzyladenosine
Property Insights of 5'-(N-Methylcarboxamido)-N(6)-benzyladenosine
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5'-(N-Methylcarboxamido)-N(6)-benzyladenosine. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5'-(N-Methylcarboxamido)-N(6)-benzyladenosine. Following Lipinski's Rule of Five, 5'-(N-Methylcarboxamido)-N(6)-benzyladenosine 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 5'-(N-Methylcarboxamido)-N(6)-benzyladenosine?
The CAS number of 5'-(N-Methylcarboxamido)-N(6)-benzyladenosine is 152918-15-5.
What is the molecular formula of 5'-(N-Methylcarboxamido)-N(6)-benzyladenosine?
The molecular formula of 5'-(N-Methylcarboxamido)-N(6)-benzyladenosine is C18H20N6O4.
What is the molecular weight of 5'-(N-Methylcarboxamido)-N(6)-benzyladenosine?
The molecular weight of 5'-(N-Methylcarboxamido)-N(6)-benzyladenosine is 384.1546 g/mol.
Where can I buy 5'-(N-Methylcarboxamido)-N(6)-benzyladenosine?
You can request a quote for 5'-(N-Methylcarboxamido)-N(6)-benzyladenosine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5'-(N-Methylcarboxamido)-N(6)-benzyladenosine?
Yes, CoreyChem provides custom synthesis services for 5'-(N-Methylcarboxamido)-N(6)-benzyladenosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.