303996-79-4
Product Name:
3-[4-(DIMETHYLAMINO)PHENYL]-2-[5-(1H-1,2,4-TRIAZOL-1-YLMETHYL)-1H-1,2,4-TRIAZOL-3-YL]ACRYLONITRILE
Formula:
C16H16N8
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 320.35 g/mol |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Exact Mass | 320.14979254 g/mol |
| Monoisotopic Mass | 320.14979254 g/mol |
| Topological Polar Surface Area | 99.3 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 488 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |