815650-72-7
Product Name:
1H-1,4-Diazepine,hexahydro-1-(2-methylbenzoyl)-(9CI)
Formula:
C13H18N2O
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 218.29 g/mol |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 218.141913202 g/mol |
| Monoisotopic Mass | 218.141913202 g/mol |
| Topological Polar Surface Area | 32.3 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 242 |
| 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 |