MLS000589200 structure

MLS000589200

(E)-3-(2,4-dichlorophenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]prop-2-enamide

Also Known As: (E)-3-(2,4-dichlorophenyl)-N-((4-(morpholinomethyl)phenyl)carbamothioyl)acrylamide|(E)-3-(2,4-dichlorophenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]prop-2-enamide|1-[(E)-3-(2,4-Dichloro-phenyl)-acryloyl]-3-(4-morpholin-4-ylmethyl-phenyl)-thiourea|(2E)-3-(2,4-dichlorophenyl)-N-{[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl}prop-2-enamide

CAS: 1164515-80-3
Molecular Formula C21H21Cl2N3O2S
Molecular Weight 449.07315 g/mol
LogP 4.352
Topological Polar Surface Area 53.6 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
Rotatable Bonds 5
Exact Mass 449.07315
Monoisotopic Mass 449.07315
Heavy Atoms 29
Complexity 897.29926

Chemical Identifiers

CAS Number 1164515-80-3
SMILES C1COCCN1CC2=CC=C(C=C2)NC(=S)NC(=O)/C=C/C3=C(C=C(C=C3)Cl)Cl

Product Overview

MLS000589200 (CAS 1164515-80-3), with molecular formula C21H21Cl2N3O2S and molecular weight 449.07315 g/mol. IUPAC: (E)-3-(2,4-dichlorophenyl)-N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]prop-2-enamide.

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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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