AC1LRJMT structure

AC1LRJMT

4-[4-[(2,4-dimethylphenyl)methyl]piperazin-1-yl]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide

Also Known As: 4-(4-(2,4-dimethylbenzyl)piperazin-1-yl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide|4-[4-(2,4-dimethylbenzyl)piperazin-1-yl]-N-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxobutanamide|4-[4-[(2,4-dimethylphenyl)methyl]piperazin-1-yl]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide

CAS: 713085-33-7
Molecular Formula C21H29N5O2S
Molecular Weight 415.2042 g/mol
LogP 2.78044
Topological Polar Surface Area 78.43 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 7
Exact Mass 415.2042
Monoisotopic Mass 415.2042
Heavy Atoms 29
Complexity 858.5064

Chemical Identifiers

CAS Number 713085-33-7
SMILES CCC1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)CC3=C(C=C(C=C3)C)C

Product Overview

AC1LRJMT (CAS 713085-33-7), with molecular formula C21H29N5O2S and molecular weight 415.2042 g/mol. IUPAC: 4-[4-[(2,4-dimethylphenyl)methyl]piperazin-1-yl]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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