900294-10-2
Product Name:
3-benzyl-1-[2-(dimethylamino)ethyl]-6,7,8,9-tetrahydro-5H-cyclohepta[2,3]thieno[2,4-b]pyrimidine-2,4-dione
Formula:
C22H27N3O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 397.5 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 397.18239829 g/mol |
| Monoisotopic Mass | 397.18239829 g/mol |
| Topological Polar Surface Area | 72.1 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 578 |
| 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 |