AC1NT5TH
2-(1,3-benzothiazol-2-yl)-4-(3-hydroxypropyliminomethyl)-5-propyl-1H-pyrazol-3-one
Also Known As: CBMicro_039661|BIM-0039541.P001|SR-01000224526-1|(4E)-2-(1,3-benzothiazol-2-yl)-4-{[(3-hydroxypropyl)amino]methylidene}-5-propyl-2,4-dihydro-3H-pyrazol-3-one|2-(1,3-benzothiazol-2-yl)-4-{[(3-hydroxypropyl)amino]methylene}-5-propyl-2,4-dihydro-3H-pyrazol-3-one|2-(1,3-benzothiazol-2-yl)-4-(3-hydroxypropyliminomethyl)-5-propyl-1H-pyrazol-3-one|2-(1,3-benzothiazol-2-yl)-4-[(3-hydroxypropylamino)methylidene]-5-propylpyrazol-3-one|(4E)-2-(1,3-benzothiazol-2-yl)-4-[(3-hydroxypropylamino)methylidene]-5-propylpyrazol-3-one|(E)-2-(benzo[d]thiazol-2-yl)-4-(((3-hydroxypropyl)imino)methyl)-5-propyl-1H-pyrazol-3(2H)-one|2-(1,3-benzothiazol-2-yl)-4-{(E)-[(3-hydroxypropyl)imino]methyl}-5-propyl-1,2-dihydro-3H-pyrazol-3-one|2-(1,3-BENZOTHIAZOL-2-YL)-4-{(E)-1-[(3-HYDROXYPROPYL)AMINO]METHYLIDENE}-5-PROPYL-2,4-DIHYDRO-3H-PYRAZOL-3-ONE
| Molecular Formula | C17H20N4O2S |
|---|---|
| Molecular Weight | 344.1307 g/mol |
| LogP | 2.5291 |
| Topological Polar Surface Area | 83.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 344.1307 |
| Monoisotopic Mass | 344.1307 |
| Heavy Atoms | 24 |
| Complexity | 873.8415 |
Chemical Identifiers
| CAS Number | 337341-58-9 |
|---|---|
| SMILES | CCCC1=C(C(=O)N(N1)C2=NC3=CC=CC=C3S2)C=NCCCO |
Product Overview
AC1NT5TH (CAS 337341-58-9), with molecular formula C17H20N4O2S and molecular weight 344.1307 g/mol. IUPAC: 2-(1,3-benzothiazol-2-yl)-4-(3-hydroxypropyliminomethyl)-5-propyl-1H-pyrazol-3-one.
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