AC1MIF8Q structure

AC1MIF8Q

6-chloro-2-N-(4-chlorophenyl)-4-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-N-methyl-5-methylsulfanylpyrimidine-2,4-diamine

Also Known As: 2,4-Pyrimidinediamine, 6-chloro-N(sup 2)-(4-chlorophenyl)-N(sup 4)-(2-(2,6-dimethyl-4-morpholinyl)ethyl)-N(sup 2)-methyl-5-(methylthio)-|4-Chloro-N-(4-chlorophenyl)-6-{[2-(2,6-dimethylmorpholin-4-yl)ethyl]imino}-N-methyl-5-(methylsulfanyl)-1,6-dihydropyrimidin-2-amine|6-chloro-2-N-(4-chlorophenyl)-4-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-N-methyl-5-methylsulfanylpyrimidine-2,4-diamine

CAS: 55417-10-2
Molecular Formula C20H27Cl2N5OS
Molecular Weight 455.13135 g/mol
LogP 4.7943
Topological Polar Surface Area 53.52 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 7
Exact Mass 455.13135
Monoisotopic Mass 455.13135
Heavy Atoms 29
Complexity 813.26404

Chemical Identifiers

CAS Number 55417-10-2
SMILES CC1CN(CC(O1)C)CCNC2=C(C(=NC(=N2)N(C)C3=CC=C(C=C3)Cl)Cl)SC

Product Overview

AC1MIF8Q (CAS 55417-10-2), with molecular formula C20H27Cl2N5OS and molecular weight 455.13135 g/mol. IUPAC: 6-chloro-2-N-(4-chlorophenyl)-4-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-N-methyl-5-methylsulfanylpyrimidine-2,4-diamine.

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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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