922629-61-6
Product Name:
Benzoic acid, 4-[[(1,6-dihydro-6-oxo-4-phenyl-2-pyrimidinyl)thio]methyl]-, methyl ester
Formula:
C19H16N2O3S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 352.4 g/mol |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 352.08816355 g/mol |
| Monoisotopic Mass | 352.08816355 g/mol |
| Topological Polar Surface Area | 93.1 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 559 |
| 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 |