Bz3PdAD
TL;DR: Bz3PdAD (CAS 104076-88-2) is a chemical compound with molecular formula C27H32N6O14P2 and molecular weight 726.1452 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(3-benzoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate
Also Known As: Bz3PdAD, 3-Benzoylpyridine-adenine dinucleotide, [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(3-benzoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate, [(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [(2R,3S,4R,5R)-5-(3-benzoylpyridin-1(4H)-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen diphosphate, Adenosine 5'-(trihydrogen diphosphate), P'->5'-ester with (1,4-dihydro-1-beta-D-ribofuranosyl-3-pyridinyl)phenylmethanone
Technical Specifications
| Molecular Formula | C27H32N6O14P2 |
| Molecular Weight | 726.1452 g/mol |
| XLogP | -3.3 |
| Topological Polar Surface Area (TPSA) | 292.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 12 |
| Exact Mass | 726.1452 Da |
| Heavy Atoms | 49 |
| Complexity | 1360.0 |
| SMILES | C1C=CN(C=C1C(=O)C2=CC=CC=C2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O |
| InChIKey | PDQBXNVFMIWCME-XXQHZGKUSA-N |
Product Description
Applications: Bz3PdAD is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A fine chemical supplied by CoreyChem, Bz3PdAD (CAS 104076-88-2) has the molecular formula C27H32N6O14P2 and a molecular weight of 726.15 g/mol. Synonyms include Bz3PdAD and 3-Benzoylpyridine-adenine dinucleotide.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Bz3PdAD
Property Insights of Bz3PdAD
The XLogP value of -3.3 indicates that Bz3PdAD is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 292.0 Ų indicates high polarity, suggesting Bz3PdAD may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bz3PdAD has 7 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Bz3PdAD?
The CAS number of Bz3PdAD is 104076-88-2.
What is the molecular formula of Bz3PdAD?
The molecular formula of Bz3PdAD is C27H32N6O14P2.
What is the molecular weight of Bz3PdAD?
The molecular weight of Bz3PdAD is 726.1452 g/mol.
What are the applications of Bz3PdAD?
Bz3PdAD is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Where can I buy Bz3PdAD?
You can request a quote for Bz3PdAD directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bz3PdAD?
Yes, CoreyChem provides custom synthesis services for Bz3PdAD and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.