RefChem:272832
3-[[4-(1,3-benzothiazol-2-yldiazenyl)-N-ethyl-3-methylanilino]methyl]benzenesulfonic acid
Also Known As: EINECS 249-790-0|alpha-((4-(Benzothiazol-2-ylazo)-m-tolyl)ethylamino)-m-toluenesulphonic acid|alpha-[[4- -m-tolyl]ethylamino]-m-toluenesulphonicacid|3-{[{4-[(e)-1,3-benzothiazol-2-yldiazenyl]-3-methylphenyl}(ethyl)amino]methyl}benzenesulfonic acid|3-(((4-(2-(2-Benzothiazolyl)diazenyl)-3-methylphenyl)ethylamino)methyl)benzenesulfonic acid|3-[[[4-(2-Benzothiazolylazo)-3-methylphenyl]ethylamino]methyl]benzenesulfonic acid|3-[[[4-[2-(2-Benzothiazolyl)diazenyl]-3-methylphenyl]ethylamino]methyl]benzenesulfonic acid|3-[[4-(1,3-benzothiazol-2-yldiazenyl)-N-ethyl-3-methylanilino]methyl]benzenesulfonic acid|ALPHA-[[4-(BENZOTHIAZOL-2-YLAZO)-M-TOLYL]ETHYLAMINO]-M-TOLUENESULFONIC ACID|alpha-[[4-(benzothiazol-2-ylazo)-m-tolyl]ethylamino]-m-toluenesulphonic acid|Benzenesulfonic acid, 3-(((4-(2-benzothiazolylazo)-3-methylphenyl)ethylamino)methyl)-|Benzenesulfonic acid, 3-[[[4-(2-benzothiazolylazo) -3-methylphenyl]ethylamino]methyl]-|Benzenesulfonic acid, 3-[[[4-(2-benzothiazolylazo)-3-methylphenyl]ethylamino]methyl]-|3-[({4-[2-(1,3-benzothiazol-2-yl)diazen-1-yl]-3-methylphenyl}(ethyl)amino)methyl]benzene-1-sulfonic acid|3-{[{4-[(1,3-Benzothiazol-2-yl)diazenyl]-3-methylphenyl}(ethyl)amino]methyl}benzene-1-sulfonic acid|Benzenesulfonic acid,3-[[[4-[2-(2-benzothiazolyl)diazenyl]-3-methylphenyl]ethylamino]methyl]-
| Molecular Formula | C23H22N4O3S2 |
|---|---|
| Molecular Weight | 466.11334 g/mol |
| LogP | 6.29 |
| Topological Polar Surface Area | 95.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 466.11334 |
| Heavy Atoms | 32 |
| Complexity | 1364.4 |
Chemical Identifiers
| CAS Number | 29706-48-7 |
|---|---|
| SMILES | CCN(CC1=CC(=CC=C1)S(=O)(=O)O)C2=CC(=C(C=C2)N=NC3=NC4=CC=CC=C4S3)C |
Product Overview
RefChem:272832 (CAS 29706-48-7), with molecular formula C23H22N4O3S2 and molecular weight 466.11334 g/mol. IUPAC: 3-[[4-(1,3-benzothiazol-2-yldiazenyl)-N-ethyl-3-methylanilino]methyl]benzenesulfonic acid.
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