AC1LRKDO structure

AC1LRKDO

(5E)-5-[(1-benzylindol-3-yl)methylidene]-1-cyclopropyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Also Known As: (5E)-5-[(1-benzyl-1H-indol-3-yl)methylidene]-1-cyclopropyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione|(5E)-5-[(1-benzylindol-3-yl)methylidene]-1-cyclopropyl-2-sulfanylidene-1,3-diazinane-4,6-dione|(E)-5-((1-benzyl-1H-indol-3-yl)methylene)-1-cyclopropyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

CAS: 714247-40-2
Molecular Formula C23H19N3O2S
Molecular Weight 401.1198 g/mol
LogP 3.4787
Topological Polar Surface Area 54.34 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
Rotatable Bonds 4
Exact Mass 401.1198
Monoisotopic Mass 401.1198
Heavy Atoms 29
Complexity 1175.3109

Chemical Identifiers

CAS Number 714247-40-2
SMILES C1CC1N2C(=O)/C(=C/C3=CN(C4=CC=CC=C43)CC5=CC=CC=C5)/C(=O)NC2=S

Product Overview

AC1LRKDO (CAS 714247-40-2), with molecular formula C23H19N3O2S and molecular weight 401.1198 g/mol. IUPAC: (5E)-5-[(1-benzylindol-3-yl)methylidene]-1-cyclopropyl-2-sulfanylidene-1,3-diazinane-4,6-dione.

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