391218-99-8
Product Name:
7-bromo-4-(perchlorobenzoyl)-5-phenyl-1,3,4,5-tetrahydro-2H-benzo[e][1,4]diazepin-2-one
Formula:
C22H12BrCl5N2O2
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 593.5 g/mol |
|---|---|
| XLogP3 | 7.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 591.84953 g/mol |
| Monoisotopic Mass | 589.85248 g/mol |
| Topological Polar Surface Area | 49.4 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 696 |
| 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 |