AC1N5OQH
N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-2-[(4-methylphenyl)sulfonylamino]benzamide
Also Known As: Oprea1_143807|F1105-0368|(Z)-N-(3-methyl-6-(methylsulfonyl)benzo[d]thiazol-2(3H)-ylidene)-2-(4-methylphenylsulfonamido)benzamide|N-[(2Z)-6-methanesulfonyl-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-2-(4-methylbenzenesulfonamido)benzamide|N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-2-[(4-methylphenyl)sulfonylamino]benzamide|N-(3-methyl-6-methylsulfonyl-benzothiazol-2-ylidene)-2-[(4-methylphenyl)sulfonylamino]benzamide
| Molecular Formula | C23H21N3O5S3 |
|---|---|
| Molecular Weight | 515.06433 g/mol |
| LogP | 3.49362 |
| Topological Polar Surface Area | 114.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 515.06433 |
| Monoisotopic Mass | 515.06433 |
| Heavy Atoms | 34 |
| Complexity | 1698.8346 |
Chemical Identifiers
| CAS Number | 683237-52-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)N=C3N(C4=C(S3)C=C(C=C4)S(=O)(=O)C)C |
Product Overview
AC1N5OQH (CAS 683237-52-7), with molecular formula C23H21N3O5S3 and molecular weight 515.06433 g/mol. IUPAC: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-2-[(4-methylphenyl)sulfonylamino]benzamide.