TL;DR: 2-(Dimethylamino)-5-phenyldiazenylbenzene-1,3-disulfonic acid (CAS 125165-74-4) is a chemical compound with molecular formula C14H15N3O6S2 and molecular weight 385.04022 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(dimethylamino)-5-phenyldiazenylbenzene-1,3-disulfonic acid
Also Known As: 2-(dimethylamino)-5-phenyldiazenylbenzene-1,3-disulfonic acid, 4-Dimethylaminoazobenzene-2,6-disulfonic acid, 2-dimethylamino-5-phenyldiazenyl-benzene-1,3-disulfonic Acid, 1,3-Benzenedisulfonicacid, 2-(dimethylamino)-5-(2-phenyldiazenyl)-, 1,3-Benzenedisulfonicacid,2-(dimethylamino)-5-(phenylazo)-(9CI)
| Molecular Formula | C14H15N3O6S2 |
| Molecular Weight | 385.04022 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 153.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 385.04022 Da |
| Heavy Atoms | 25 |
| Complexity | 632.0 |
| SMILES | CN(C)C1=C(C=C(C=C1S(=O)(=O)O)N=NC2=CC=CC=C2)S(=O)(=O)O |
| InChIKey | YMARTIWNFGCMOP-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Dimethylamino)-5-phenyldiazenylbenzene-1,3-disulfonic acid. The TPSA of 153.0 Ų indicates high polarity, suggesting 2-(Dimethylamino)-5-phenyldiazenylbenzene-1,3-disulfonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-(Dimethylamino)-5-phenyldiazenylbenzene-1,3-disulfonic acid has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(Dimethylamino)-5-phenyldiazenylbenzene-1,3-disulfonic acid is 125165-74-4.
The molecular formula of 2-(Dimethylamino)-5-phenyldiazenylbenzene-1,3-disulfonic acid is C14H15N3O6S2.
The molecular weight of 2-(Dimethylamino)-5-phenyldiazenylbenzene-1,3-disulfonic acid is 385.04022 g/mol.
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