AC1LPEXI structure

AC1LPEXI

N-(5-benzyl-1,3,4-thiadiazol-2-yl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide

Also Known As: AB00336396-10|N-(5-benzyl-1,3,4-thiadiazol-2-yl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide|N-(5-benzyl-1,3,4-thiadiazol-2-yl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide|2-(1,3-dimethyl-2,6-dioxo(1,3,7-trihydropurin-7-yl))-N-[5-benzyl(1,3,4-thiadia zol-2-yl)]acetamide

CAS: 600147-29-3
Molecular Formula C18H17N7O3S
Molecular Weight 411.11136 g/mol
LogP 0.5147
Topological Polar Surface Area 116.7 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 5
Exact Mass 411.11136
Monoisotopic Mass 411.11136
Heavy Atoms 29
Complexity 1316.972

Chemical Identifiers

CAS Number 600147-29-3
SMILES CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC3=NN=C(S3)CC4=CC=CC=C4

Product Overview

AC1LPEXI (CAS 600147-29-3), with molecular formula C18H17N7O3S and molecular weight 411.11136 g/mol. IUPAC: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide.

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