339022-67-2
Product Name:
3-ACETYL-4-[(4-METHYLPHENYL)SULFANYL]-2,5-DIHYDRO-1H-1LAMBDA6-THIOPHENE-1,1-DIONE
Formula:
C13H14O3S2
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 282.4 g/mol |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 282.03843665 g/mol |
| Monoisotopic Mass | 282.03843665 g/mol |
| Topological Polar Surface Area | 84.9 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 463 |
| 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 |