AC1NVP2S

2-(1,3-benzothiazol-2-yl)-4-[3-(diethylamino)propyliminomethyl]-5-propyl-1H-pyrazol-3-one

Also Known As: BAS 01257396|AK-968/12573015|(E)-2-(benzo[d]thiazol-2-yl)-4-(((3-(diethylamino)propyl)imino)methyl)-5-propyl-1H-pyrazol-3(2H)-one|2-(1,3-Benzothiazol-2-yl)-4-[3-(diethylamino)propyliminomethyl]-5-propyl-1H-pyrazol-3-one|(4E)-2-(1,3-benzothiazol-2-yl)-4-({[3-(diethylamino)propyl]amino}methylidene)-5-propyl-2,4-dihydro-3H-pyrazol-3-one|(4E)-2-(1,3-benzothiazol-2-yl)-4-[[3-(diethylamino)propylamino]methylidene]-5-propylpyrazol-3-one|2-(1,3-benzothiazol-2-yl)-4-({[3-(diethylamino)propyl]imino}methyl)-5-propyl-1,2-dihydro-3H-pyrazol-3-one|2-(1,3-benzothiazol-2-yl)-4-[(E)-{[3-(diethylamino)propyl]imino}methyl]-5-propyl-1,2-dihydro-3H-pyrazol-3-one|2-(1,3-benzothiazol-2-yl)-4-[[3-(diethylamino)propylamino]methylidene]-5-propylpyrazol-3-one

Molecular Formula	C21H29N5OS
Molecular Weight	399.2093 g/mol
LogP	3.8786
Topological Polar Surface Area	66.28 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	10
Exact Mass	399.2093
Monoisotopic Mass	399.2093
Heavy Atoms	28
Complexity	947.25586

Chemical Identifiers

CAS Number	337341-52-3
SMILES	CCCC1=C(C(=O)N(N1)C2=NC3=CC=CC=C3S2)C=NCCCN(CC)CC