Pin1 modulator 1 structure

Pin1 modulator 1

4-[(5E)-5-(naphthalen-1-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid

Also Known As: Pin1 modulator 1|BAS 00872046|F1142-4272|4-[(5E)-5-[(naphthalen-1-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid|4-[(5E)-5-(naphthalen-1-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid|(E)-4-(5-(naphthalen-1-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid|4-(5-(Naphthalen-1-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid|4-(5-(Phthalen-1-Ylmethylene)-4-Oxo-2-Thioxothiazolidin-3-Yl)Butanoic Acid|4-[(5E)-5-(naphthalen-1-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoic acid|4-[(E)-5-[(1-naphthyl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butyric acid|4-(5E)-5-(naphthalen-1-yl)methylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-ylbutanoic acid

CAS: 301688-74-4
Molecular Formula C18H15NO3S2
Molecular Weight 357.04935 g/mol
LogP 3.9058
Topological Polar Surface Area 57.61 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 5
Exact Mass 357.04935
Monoisotopic Mass 357.04935
Heavy Atoms 24
Complexity 854.96765

Chemical Identifiers

CAS Number 301688-74-4
SMILES C1=CC=C2C(=C1)C=CC=C2/C=C/3\C(=O)N(C(=S)S3)CCCC(=O)O

Product Overview

Pin1 modulator 1 (CAS 301688-74-4), with molecular formula C18H15NO3S2 and molecular weight 357.04935 g/mol. IUPAC: 4-[(5E)-5-(naphthalen-1-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid.

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