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861207-47-8

861207-47-8 structural image
Product Name: 3-(4-ISOPROPYLPHENYL)-3-[(2-THIENYLCARBONYL)AMINO]PROPANOIC ACID
Formula: C17H19NO3S
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COMPUTED DESCRIPTORS

Molecular Weight 317.4 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 317.10856464 g/mol
Monoisotopic Mass 317.10856464 g/mol
Topological Polar Surface Area 94.6 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 391
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes