371939-83-2
Product Name:
2-[(2,4-dimethylbenzyl)sulfanyl]-3-(4-methoxyphenyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Formula:
C25H24N2O2S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 448.6 g/mol |
|---|---|
| XLogP3 | 6.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 448.12792036 g/mol |
| Monoisotopic Mass | 448.12792036 g/mol |
| Topological Polar Surface Area | 95.4 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 693 |
| 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 |