Base information

Cat. No.
CAS No.854107-53-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C13H16N2OS
Molecular Weight 248.344
Exact Mass 248.098
XLogP3 2.9058
Mr 77.14
PSA 57.97
Sequence -
Atom number 33
Bond number 34
Ring number 2
Rotor number 3
Residues number 0
Canonical smiles CCC/N=C/1\SCC(=O)N1c1ccccc1C

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