AC1MIITC structure

AC1MIITC

3-(2-chlorophenyl)-2-(2-phenylethyl)-2,5,6,7-tetrahydro-[1,3]thiazolo[3,2-a]pyrimidin-3-ol;hydrobromide

Also Known As: 5H-Thiazolo(3,2-a)pyrimidin-3-ol, 3-(2-chlorophenyl)-2,3,6,7-tetrahydro-2-(2-phenylethyl)-, monohydrobromide|9-(2-chlorophenyl)-8-phenethyl-7-thia-1,5-diazabicyclo[4.3.0]non-5-en-9-ol Hydrobromide|3-(2-Chlorophenyl)-2-(2-phenylethyl)-2,3,6,7-tetrahydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-ol--hydrogen bromide (1/1)|3-(2-chlorophenyl)-2-phenethyl-2,5,6,7-tetrahydro-[1,3]thiazolo[3,2-a]pyrimidin-3-ol hydrobromide

CAS: 86346-95-4
Molecular Formula C20H22BrClN2OS
Molecular Weight 452.03247 g/mol
LogP 4.8729
Topological Polar Surface Area 35.83 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 4
Exact Mass 452.03247
Monoisotopic Mass 452.03247
Heavy Atoms 26
Complexity 788.39044

Chemical Identifiers

CAS Number 86346-95-4
SMILES C1CN=C2N(C1)C(C(S2)CCC3=CC=CC=C3)(C4=CC=CC=C4Cl)O.Br

Product Overview

AC1MIITC (CAS 86346-95-4), with molecular formula C20H22BrClN2OS and molecular weight 452.03247 g/mol. IUPAC: 3-(2-chlorophenyl)-2-(2-phenylethyl)-2,5,6,7-tetrahydro-[1,3]thiazolo[3,2-a]pyrimidin-3-ol;hydrobromide.

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