10'-O-Demethylstreptonigrin
TL;DR: 10'-O-Demethylstreptonigrin (CAS 105933-56-0) is a chemical compound with molecular formula C24H20N4O8 and molecular weight 492.1281 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-amino-6-(7-amino-6-methoxy-5,8-dioxoquinolin-2-yl)-4-(2,4-dihydroxy-3-methoxyphenyl)-3-methylpyridine-2-carboxylic acid
Also Known As: 10'-O-Demethylstreptonigrin, 10'-O-Desmethylstreptonigrin, Streptonigrin, 10'-O-demethyl, (4E)-5-amino-6-(7-amino-6-methoxy-5,8-dioxoquinolin-2-yl)-4-(2-hydroxy-3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-3-methyl-1H-pyridine-2-carboxylic acid, 5-Amino-6-(7-amino-5,8-dihydro-6-methoxy-5,8-dioxo-2-quinolinyl)-4-(2,4-dihydroxy-3-methoxyphenyl)-3-methyl-2-pyridinecarboxylic acid
Technical Specifications
| Molecular Formula | C24H20N4O8 |
| Molecular Weight | 492.1281 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 208.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 492.1281 Da |
| Heavy Atoms | 36 |
| Complexity | 928.0 |
| SMILES | CC1=C(C(=C(N=C1C(=O)O)C2=NC3=C(C=C2)C(=O)C(=C(C3=O)N)OC)N)C4=C(C(=C(C=C4)O)OC)O |
| InChIKey | ZZWQUUNNKHFSKR-UHFFFAOYSA-N |
Chemical Property Profile of 10'-O-Demethylstreptonigrin
Property Insights of 10'-O-Demethylstreptonigrin
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 10'-O-Demethylstreptonigrin. The TPSA of 208.0 Ų indicates high polarity, suggesting 10'-O-Demethylstreptonigrin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 10'-O-Demethylstreptonigrin has 5 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 10'-O-Demethylstreptonigrin?
The CAS number of 10'-O-Demethylstreptonigrin is 105933-56-0.
What is the molecular formula of 10'-O-Demethylstreptonigrin?
The molecular formula of 10'-O-Demethylstreptonigrin is C24H20N4O8.
What is the molecular weight of 10'-O-Demethylstreptonigrin?
The molecular weight of 10'-O-Demethylstreptonigrin is 492.1281 g/mol.
Where can I buy 10'-O-Demethylstreptonigrin?
You can request a quote for 10'-O-Demethylstreptonigrin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 10'-O-Demethylstreptonigrin?
Yes, CoreyChem provides custom synthesis services for 10'-O-Demethylstreptonigrin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.