343373-31-9
Product Name:
4-(4-ISOPROPYLPHENYL)-2-(3-NITRO-2-PYRIDINYL)-2,4-DIHYDRO-3H-1,2,4-TRIAZOL-3-ONE
Formula:
C16H15N5O3
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | 11.3 [ug/mL] (The mean of the results at pH 7.4) |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 325.32 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 325.11748936 g/mol |
| Monoisotopic Mass | 325.11748936 g/mol |
| Topological Polar Surface Area | 94.6 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 510 |
| 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 |