azidonitrophenylaminobutyryl-ADP
TL;DR: azidonitrophenylaminobutyryl-ADP (CAS 76833-32-4) is a chemical compound with molecular formula C20H24N10O13P2 and molecular weight 674.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-4-hydroxy-5-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] 4-(4-azido-2-nitroanilino)butanoate
Also Known As: Azidonitrophenylaminobutyryl-ADP, Azidonitrophenylaminobutyryl-adenosine diphosphate, [(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-4-hydroxy-5-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] 4-(4-azido-2-nitroanilino)butanoate, Adenosine 5'-(trihydrogen diphosphate), 2'-(4-((4-azido-2-nitrophenyl)amino)butanoate), 2'-O-[4-(4-Azido-2-nitroanilino)butanoyl]adenosine 5'-(trihydrogen diphosphate)
| Molecular Formula | C20H24N10O13P2 |
|---|---|
| Molecular Weight | 674.10 g/mol |
| LogP | 1.5472 |
| Topological Polar Surface Area | 342.6 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 14 |
| Exact Mass | 674.1 |
| Heavy Atoms | 45 |
| Complexity | 1728.3138 |
Chemical Identifiers
| CAS Number | 76833-32-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1N=[N+]=[N-])[N+](=O)[O-])NCCCC(=O)O[C@@H]2[C@@H]([C@H](O[C@H]2N3C=NC4=C(N=CN=C43)N)COP(=O)(O)OP(=O)(O)O)O |
Product Overview
azidonitrophenylaminobutyryl-ADP (CAS 76833-32-4), with molecular formula C20H24N10O13P2 and molecular weight 674.10 g/mol. IUPAC: [(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-4-hydroxy-5-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] 4-(4-azido-2-nitroanilino)butanoate.
Chemical Property Profile of azidonitrophenylaminobutyryl-ADP
Property Insights of azidonitrophenylaminobutyryl-ADP
The XLogP value of 1.5472 suggests moderate lipophilicity, balancing water solubility and membrane permeability for azidonitrophenylaminobutyryl-ADP. The TPSA of 342.6 Ų indicates high polarity, suggesting azidonitrophenylaminobutyryl-ADP may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, azidonitrophenylaminobutyryl-ADP has 6 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of azidonitrophenylaminobutyryl-ADP?
The CAS number of azidonitrophenylaminobutyryl-ADP is 76833-32-4.
What is the molecular formula of azidonitrophenylaminobutyryl-ADP?
The molecular formula of azidonitrophenylaminobutyryl-ADP is C20H24N10O13P2.
What is the molecular weight of azidonitrophenylaminobutyryl-ADP?
The molecular weight of azidonitrophenylaminobutyryl-ADP is 674.10 g/mol.
Where can I buy azidonitrophenylaminobutyryl-ADP?
You can request a quote for azidonitrophenylaminobutyryl-ADP directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for azidonitrophenylaminobutyryl-ADP?
Yes, KEHONG BIO provides custom synthesis services for azidonitrophenylaminobutyryl-ADP and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.