AC1NT2LR

2-(1,3-benzothiazol-2-yl)-4-(3-hydroxypropyliminomethyl)-5-phenyl-1H-pyrazol-3-one

Also Known As: CBMicro_034256|BAS 01355526|BIM-0034348.P001|AK-968/10637034|(4E)-2-(1,3-benzothiazol-2-yl)-4-{[(3-hydroxypropyl)amino]methylidene}-5-phenyl-2,4-dihydro-3H-pyrazol-3-one|2-(1,3-benzothiazol-2-yl)-4-{(E)-[(3-hydroxypropyl)imino]methyl}-5-phenyl-1,2-dihydro-3H-pyrazol-3-one|2-(1,3-benzothiazol-2-yl)-4-[(3-hydroxypropylamino)methylidene]-5-phenylpyrazol-3-one|(4E)-2-(1,3-benzothiazol-2-yl)-4-[(3-hydroxypropylamino)methylidene]-5-phenylpyrazol-3-one|(4Z)-2-(1,3-benzothiazol-2-yl)-4-[(3-hydroxypropylamino)methylidene]-5-phenylpyrazol-3-one|(4Z)-2-(1,3-benzothiazol-2-yl)-4-{[(3-hydroxypropyl)amino]methylene}-5-phenyl-2,4-dihydro-3H-pyrazol-3-one|(E)-1-(benzo[d]thiazol-2-yl)-4-(((3-hydroxypropyl)amino)methylene)-3-phenyl-1H-pyrazol-5(4H)-one|2-(1,3-benzothiazol-2-yl)-4-{[(3-hydroxypropyl)amino]methylene}-5-phenyl-2,4-dihydro-3H-pyrazol-3-one

Molecular Formula	C20H18N4O2S
Molecular Weight	378.11505 g/mol
LogP	3.2436
Topological Polar Surface Area	83.27 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	378.11505
Monoisotopic Mass	378.11505
Heavy Atoms	27
Complexity	1108.7207

Chemical Identifiers

CAS Number	337474-84-7
SMILES	C1=CC=C(C=C1)C2=C(C(=O)N(N2)C3=NC4=CC=CC=C4S3)C=NCCCO