TL;DR: C34H25N9O13S2 (CAS 116962-64-2) is a chemical compound with molecular formula C34H25N9O13S2 and molecular weight 831.1013 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6Z)-4-amino-3-[[4-[2-(2,6-dihydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]phenyl]diazenyl]-6-[[4-[2-(2,6-dihydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]phenyl]hydrazinylidene]-5-oxonaphthalene-2,7-disulfonic acid
Also Known As: 2,7-Naphthalenedisulfonic acid, 4-amino-3,6-bis((4-((2,4,6-trihydroxyphenyl)azo)phenyl)azo)-5-hydroxy-
| Molecular Formula | C34H25N9O13S2 |
| Molecular Weight | 831.1013 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 382.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 10 |
| Exact Mass | 831.1013 Da |
| Heavy Atoms | 58 |
| Complexity | 2170.0 |
| SMILES | C1=CC(=CC=C1NN=C2C(=CC(=O)C=C2O)O)N/N=C/3\C(=CC4=CC(=C(C(=C4C3=O)N)N=NC5=CC=C(C=C5)NN=C6C(=CC(=O)C=C6O)O)S(=O)(=O)O)S(=O)(=O)O |
| InChIKey | WSCAJOAHOWZZPZ-VBFDJFJVSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C34H25N9O13S2. The TPSA of 382.0 Ų indicates high polarity, suggesting C34H25N9O13S2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C34H25N9O13S2 has 10 hydrogen bond donor(s) and 22 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of C34H25N9O13S2 is 116962-64-2.
The molecular formula of C34H25N9O13S2 is C34H25N9O13S2.
The molecular weight of C34H25N9O13S2 is 831.1013 g/mol.
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