495401-90-6
Product Name:
PYRIMIDINE, 4-(4-CHLOROPHENOXY)-6-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-2-(METHYLTHIO)-
Formula:
C16H15ClN4OS
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 346.8 g/mol |
|---|---|
| XLogP3 | 4.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 346.0655100 g/mol |
| Monoisotopic Mass | 346.0655100 g/mol |
| Topological Polar Surface Area | 78.1 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 383 |
| 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 |