1657014-33-9
Product Name:
2-(4-butoxy-3-cyanophenyl)-4-methylthiazole-5-carboxylic acid
Formula:
C16H16N2O3S
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COMPUTED DESCRIPTORS
Molecular Weight | 316.4 g/mol |
---|---|
XLogP3 | 3.8 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 6 |
Exact Mass | 316.08816355 g/mol |
Monoisotopic Mass | 316.08816355 g/mol |
Topological Polar Surface Area | 111 Ų |
Heavy Atom Count | 22 |
Formal Charge | 0 |
Complexity | 436 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |