8-Dhdc-fad
TL;DR: 8-Dhdc-fad (CAS 104324-33-6) is a chemical compound with molecular formula C27H32N8O16P2 and molecular weight 786.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [2,3,4-trihydroxy-5-(7-methyl-2,4,8-trioxo-1H-pyrimido[4,5-b]quinolin-10-yl)pentyl] hydrogen phosphate
Also Known As: 8-Dhdc-fad, 8-Demethyl-8-hydroxy-5-deaza-5-carba-fad, [[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [2,3,4-trihydroxy-5-(7-methyl-2,4,8-trioxo-1H-pyrimido[4,5-b]quinolin-10-yl)pentyl] hydrogen phosphate, P inverted exclamation marka inverted exclamation marku5-ester with 1-deoxy-1-(3,4-dihydro-8-hydroxy-7-methyl-2,4-dioxopyrimido[4,5-b]quinolin-10(2H)-yl)-D-ribitol adenosine 5 inverted exclamation marka-(trihydrogen diphosphate)
| Molecular Formula | C27H32N8O16P2 |
|---|---|
| Molecular Weight | 786.14 g/mol |
| LogP | -6.2 |
| Topological Polar Surface Area | 361.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 13 |
| Exact Mass | 786.1412 |
| Heavy Atoms | 53 |
| Complexity | 1740.0 |
Chemical Identifiers
| CAS Number | 104324-33-6 |
|---|---|
| SMILES | CC1=CC2=CC3=C(NC(=O)NC3=O)N(C2=CC1=O)CC(C(C(COP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O |
| InChIKey | STDZKPOWOJIPDH-UHFFFAOYSA-N |
Product Overview
8-Dhdc-fad (CAS 104324-33-6), with molecular formula C27H32N8O16P2 and molecular weight 786.14 g/mol. IUPAC: [[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [2,3,4-trihydroxy-5-(7-methyl-2,4,8-trioxo-1H-pyrimido[4,5-b]quinolin-10-yl)pentyl] hydrogen phosphate.
Chemical Property Profile of 8-Dhdc-fad
Property Insights of 8-Dhdc-fad
The XLogP value of -6.2 indicates that 8-Dhdc-fad is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 361.0 Ų indicates high polarity, suggesting 8-Dhdc-fad may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 8-Dhdc-fad has 10 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8-Dhdc-fad?
The CAS number of 8-Dhdc-fad is 104324-33-6.
What is the molecular formula of 8-Dhdc-fad?
The molecular formula of 8-Dhdc-fad is C27H32N8O16P2.
What is the molecular weight of 8-Dhdc-fad?
The molecular weight of 8-Dhdc-fad is 786.14 g/mol.
Where can I buy 8-Dhdc-fad?
You can request a quote for 8-Dhdc-fad directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Dhdc-fad?
Yes, KEHONG BIO provides custom synthesis services for 8-Dhdc-fad and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.