380436-86-2
Product Name:
[1]Benzothieno[2,3-d]pyrimidin-4(1H)-one, 3-(2,5-dimethylphenyl)-2,3,5,6,7,8-hexahydro-2-thioxo-
Formula:
C18H18N2OS2
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 342.5 g/mol |
|---|---|
| XLogP3 | 4.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 342.08605555 g/mol |
| Monoisotopic Mass | 342.08605555 g/mol |
| Topological Polar Surface Area | 92.7 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 511 |
| 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 |