133032-36-7
Product Name:
3-(4-BUTYL-PHENYL)-2-MERCAPTO-3H-QUINAZOLIN-4-ONE
Formula:
C18H18N2OS
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COMPUTED DESCRIPTORS
Molecular Weight | 310.4 g/mol |
---|---|
XLogP3 | 4.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 4 |
Exact Mass | 310.11398438 g/mol |
Monoisotopic Mass | 310.11398438 g/mol |
Topological Polar Surface Area | 64.4 Ų |
Heavy Atom Count | 22 |
Formal Charge | 0 |
Complexity | 417 |
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 |