733030-56-3
Product Name:
2-(1-CHLOROETHYL)-7-METHYL-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-4(3H)-ONE
Formula:
C13H15ClN2OS
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COMPUTED DESCRIPTORS
Molecular Weight | 282.79 g/mol |
---|---|
XLogP3 | 3.4 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 1 |
Exact Mass | 282.0593620 g/mol |
Monoisotopic Mass | 282.0593620 g/mol |
Topological Polar Surface Area | 69.7 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 401 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 2 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |