腺苷-5'-N-乙基甲酰胺
TL;DR: 腺苷-5'-N-乙基甲酰胺 (CAS 35920-39-9) is a chemical compound with molecular formula C12H16N6O4 and molecular weight 308.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
腺苷-5'-N-乙基甲酰胺
(2S,3S,4R)-5-(6-aminopurin-9-yl)-N-ethyl-3,4-dihydroxyoxolane-2-carboxamide
Also Known As: NECA, N-Ethylcarboxamidoadenosine, 5'-N-Ethylcarboxamidoadenosine, Adenosine-5'-N-ethyluronamide, N6-Ethyl-carboxamido Adenosine
| Molecular Formula | C12H16N6O4 |
|---|---|
| Molecular Weight | 308.12 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.1233 |
| Heavy Atoms | 22 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 35920-39-9 |
|---|---|
| SMILES | CCNC(=O)[C@@H]1[C@H]([C@H](C(O1)N2C=NC3=C(N=CN=C32)N)O)O |
| InChIKey | JADDQZYHOWSFJD-QQIVLSGASA-N |
Product Overview
腺苷-5'-N-乙基甲酰胺 (CAS 35920-39-9), with molecular formula C12H16N6O4 and molecular weight 308.12 g/mol. IUPAC: (2S,3S,4R)-5-(6-aminopurin-9-yl)-N-ethyl-3,4-dihydroxyoxolane-2-carboxamide.
Chemical Property Profile of 腺苷-5'-N-乙基甲酰胺
Property Insights of 腺苷-5'-N-乙基甲酰胺
The XLogP value of -0.7 indicates that 腺苷-5'-N-乙基甲酰胺 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 148.0 Ų indicates high polarity, suggesting 腺苷-5'-N-乙基甲酰胺 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 腺苷-5'-N-乙基甲酰胺 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
Frequently Asked Questions
What is the CAS number of 腺苷-5'-N-乙基甲酰胺?
The CAS number of 腺苷-5'-N-乙基甲酰胺 is 35920-39-9.
What is the molecular formula of 腺苷-5'-N-乙基甲酰胺?
The molecular formula of 腺苷-5'-N-乙基甲酰胺 is C12H16N6O4.
What is the molecular weight of 腺苷-5'-N-乙基甲酰胺?
The molecular weight of 腺苷-5'-N-乙基甲酰胺 is 308.12 g/mol.
Where can I buy 腺苷-5'-N-乙基甲酰胺?
You can request a quote for 腺苷-5'-N-乙基甲酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 腺苷-5'-N-乙基甲酰胺?
Yes, KEHONG BIO provides custom synthesis services for 腺苷-5'-N-乙基甲酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.