Biotinyl-adenoside diphosphate
TL;DR: Biotinyl-adenoside diphosphate (CAS 100844-62-0) is a chemical compound with molecular formula C28H45N9O13P2S and molecular weight 809.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,4-dihydroxy-5-[6-[[2-oxo-2-[6-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]hexylamino]ethyl]amino]purin-9-yl]oxolan-2-yl]methyl phosphono hydrogen phosphate
Also Known As: Biotinyl-ADP, Biotinyl-adenoside diphosphate, [3,4-dihydroxy-5-[6-[[2-oxo-2-[6-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]hexylamino]ethyl]amino]purin-9-yl]oxolan-2-yl]methyl phosphono hydrogen phosphate, 2-orthofluorophenyl-2H-1,4-benzothiazine-3-thione-4-acetic acid, Hydrazinecarbodithioic acid, 2-(2-pyridinylmethyl)-, methyl ester
| Molecular Formula | C28H45N9O13P2S |
|---|---|
| Molecular Weight | 809.23 g/mol |
| LogP | -3.3 |
| Topological Polar Surface Area | 343.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 21 |
| Exact Mass | 809.2333 |
| Heavy Atoms | 53 |
| Complexity | 1360.0 |
Chemical Identifiers
| CAS Number | 100844-62-0 |
|---|---|
| SMILES | C1C2C(C(S1)CCCCC(=O)NCCCCCCNC(=O)CNC3=C4C(=NC=N3)N(C=N4)C5C(C(C(O5)COP(=O)(O)OP(=O)(O)O)O)O)NC(=O)N2 |
| InChIKey | DMZDLCTXFPJCIZ-UHFFFAOYSA-N |
Product Overview
Biotinyl-adenoside diphosphate (CAS 100844-62-0), with molecular formula C28H45N9O13P2S and molecular weight 809.23 g/mol. IUPAC: [3,4-dihydroxy-5-[6-[[2-oxo-2-[6-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]hexylamino]ethyl]amino]purin-9-yl]oxolan-2-yl]methyl phosphono hydrogen phosphate.
Chemical Property Profile of Biotinyl-adenoside diphosphate
Property Insights of Biotinyl-adenoside diphosphate
The XLogP value of -3.3 indicates that Biotinyl-adenoside diphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 343.0 Ų indicates high polarity, suggesting Biotinyl-adenoside diphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Biotinyl-adenoside diphosphate has 10 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Biotinyl-adenoside diphosphate?
The CAS number of Biotinyl-adenoside diphosphate is 100844-62-0.
What is the molecular formula of Biotinyl-adenoside diphosphate?
The molecular formula of Biotinyl-adenoside diphosphate is C28H45N9O13P2S.
What is the molecular weight of Biotinyl-adenoside diphosphate?
The molecular weight of Biotinyl-adenoside diphosphate is 809.23 g/mol.
Where can I buy Biotinyl-adenoside diphosphate?
You can request a quote for Biotinyl-adenoside diphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Biotinyl-adenoside diphosphate?
Yes, KEHONG BIO provides custom synthesis services for Biotinyl-adenoside diphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.