TL;DR: RefChem:83468 (CAS 15145-44-5) is a chemical compound with molecular formula C30H19N5Na2O6S2 and molecular weight 655.0572 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
disodium;4-[[4-[(4-aminonaphthalen-1-yl)diazenyl]naphthalen-1-yl]diazenyl]naphthalene-2,7-disulfonate
Also Known As: azanium,sodium,hydrogen phosphate, 4-((4-((4-Amino-1-naphthyl)azo)-1-naphthyl)azo)-2,7-naphthalenedisulfonic acid, disodium salt, 4-((4-((4-Amino-1-naphthyl)azo)-1-naphthyl)azo)naphthalene-2,7-disulphonic acid, sodium salt, 2,7-Naphthalenedisulfonic acid, 4-((4-((4-amino-1-naphthalenyl)azo)-1-naphthalenyl)azo)-, disodium salt, 2,7-Naphthalenedisulfonic acid, 4-(2-(4-(2-(4-amino-1-naphthalenyl)diazenyl)-1-naphthalenyl)diazenyl)-, sodium salt (1:2)
| Molecular Formula | C30H19N5Na2O6S2 |
| Molecular Weight | 655.0572 g/mol |
| XLogP | 1.3754 |
| Topological Polar Surface Area (TPSA) | 207.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 4 |
| Exact Mass | 655.0572 Da |
| Heavy Atoms | 45 |
| Complexity | 1220.0 |
| SMILES | C1=CC=C2C(=C1)C(=CC=C2N=NC3=CC=C(C4=CC=CC=C43)N=NC5=C6C=CC(=CC6=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+] |
| InChIKey | MRAFCOAGDMSWHZ-UHFFFAOYSA-L |
The XLogP value of 1.3754 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:83468. The TPSA of 207.0 Ų indicates high polarity, suggesting RefChem:83468 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:83468 has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:83468 is 15145-44-5.
The molecular formula of RefChem:83468 is C30H19N5Na2O6S2.
The molecular weight of RefChem:83468 is 655.0572 g/mol.
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