Nicotinamide 2-azidoadenine dinucleotide
TL;DR: Nicotinamide 2-azidoadenine dinucleotide (CAS 14861-12-2) is a chemical compound with molecular formula C21H26N10O14P2 and molecular weight 704.11053 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[[(2R,3S,4R,5R)-5-(6-amino-2-azidopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate
Also Known As: 2-Azido-NAD, 2N3NAD, 2-Azidoadenosine dinucleotide, Nicotinamide 2-azidoadenine dinucleotide, KST-1A1533
Technical Specifications
| Molecular Formula | C21H26N10O14P2 |
| Molecular Weight | 704.11053 g/mol |
| XLogP | -4.8 |
| Topological Polar Surface Area (TPSA) | 335.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 12 |
| Exact Mass | 704.11053 Da |
| Heavy Atoms | 47 |
| Complexity | 1280.0 |
| SMILES | C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=C(N=C54)N=[N+]=[N-])N)O)O)O)O)C(=O)N |
| InChIKey | VTOZZJOLJUEVPD-NAJQWHGHSA-N |
Chemical Property Profile of Nicotinamide 2-azidoadenine dinucleotide
Property Insights of Nicotinamide 2-azidoadenine dinucleotide
The XLogP value of -4.8 indicates that Nicotinamide 2-azidoadenine dinucleotide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 335.0 Ų indicates high polarity, suggesting Nicotinamide 2-azidoadenine dinucleotide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Nicotinamide 2-azidoadenine dinucleotide has 7 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Nicotinamide 2-azidoadenine dinucleotide?
The CAS number of Nicotinamide 2-azidoadenine dinucleotide is 14861-12-2.
What is the molecular formula of Nicotinamide 2-azidoadenine dinucleotide?
The molecular formula of Nicotinamide 2-azidoadenine dinucleotide is C21H26N10O14P2.
What is the molecular weight of Nicotinamide 2-azidoadenine dinucleotide?
The molecular weight of Nicotinamide 2-azidoadenine dinucleotide is 704.11053 g/mol.
Where can I buy Nicotinamide 2-azidoadenine dinucleotide?
You can request a quote for Nicotinamide 2-azidoadenine dinucleotide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Nicotinamide 2-azidoadenine dinucleotide?
Yes, CoreyChem provides custom synthesis services for Nicotinamide 2-azidoadenine dinucleotide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.