488826-69-3
Product Name:
1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-1-[4-[(4-bromophenyl)methoxy]phenyl]ethylideneamino]-5-methyltriazole-4-carboxamide
Formula:
C21H19BrN8O3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 511.3 g/mol |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 7 |
| Exact Mass | 510.07635 g/mol |
| Monoisotopic Mass | 510.07635 g/mol |
| Topological Polar Surface Area | 146 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 684 |
| 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 |