175136-37-5
Product Name:
(8-BROMO-3,4-DIHYDRO-2H-1,5-BENZODIOXEPIN-7-YL)(4-BROMOPHENYL)METHANONE
Formula:
C16H12Br2O3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 412.07 g/mol |
|---|---|
| XLogP3 | 4.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 411.91327 g/mol |
| Monoisotopic Mass | 409.91532 g/mol |
| Topological Polar Surface Area | 35.5 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 369 |
| 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 |