903858-41-3
Product Name:
methyl 2-(1-(2-(benzylamino)-2-oxoethyl)-2,4-dioxo-6,7-dihydro-1H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(2H,4H,5H)-yl)acetate
Formula:
C21H21N3O5S
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COMPUTED DESCRIPTORS
Molecular Weight | 427.5 g/mol |
---|---|
XLogP3 | 2.3 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 7 |
Exact Mass | 427.12019195 g/mol |
Monoisotopic Mass | 427.12019195 g/mol |
Topological Polar Surface Area | 124 Ų |
Heavy Atom Count | 30 |
Formal Charge | 0 |
Complexity | 711 |
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 |