339104-04-0
Product Name:
2-HYDROXY-6-[1-(1H-1,2,4-TRIAZOL-1-YL)ETHYL]NICOTINONITRILE
Formula:
C10H9N5O
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 215.21 g/mol |
|---|---|
| XLogP3 | 0.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 215.08070993 g/mol |
| Monoisotopic Mass | 215.08070993 g/mol |
| Topological Polar Surface Area | 83.6 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 416 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |