476279-62-6
Product Name:
Benzenepropanenitrile, 3-bromo-α-(1,3-dihydro-1-methyl-2H-benzimidazol-2-ylidene)-β-oxo-
Formula:
C17H12BrN3O
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 354.2 g/mol |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 353.01637 g/mol |
| Monoisotopic Mass | 353.01637 g/mol |
| Topological Polar Surface Area | 61.8 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 497 |
| 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 |