861629-01-8
Product Name:
(5E)-6-oxo-5-[(pyridin-1-ium-3-ylmethylamino)methylidene]-2-sulfanylidene-1-(2,4,6-trimethylphenyl)pyrimidin-4-olate
Formula:
C20H20N4O2S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 380.5 g/mol |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 380.13069707 g/mol |
| Monoisotopic Mass | 380.13069707 g/mol |
| Topological Polar Surface Area | 110 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 636 |
| 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 |