1000574-97-9
Product Name:
Isopropyl2,5-dihydro-5-oxo-1-(4-phenoxyphenyl)-1H-1,2,4-triazole-3-carboxylate
Formula:
C18H17N3O4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 339.3 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 339.12190603 g/mol |
| Monoisotopic Mass | 339.12190603 g/mol |
| Topological Polar Surface Area | 80.2 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 520 |
| 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 |