82808-81-9
Product Name:
7H-Isoquino(2,1-d)(1,4)benzodiazepin-8-ium, 9,10-dihydro-3-chloro-12,1 3-dimethoxy-6-(p-tolyl)-, bromide
Formula:
C26H24ClN2O2.Br
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 511.8 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 510.07097 g/mol |
| Monoisotopic Mass | 510.07097 g/mol |
| Topological Polar Surface Area | 33.8 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 714 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |