444153-16-6
Product Name:
butyl 4-[2-(4-chlorophenyl)-3H-1,3,4-benzotriazepin-5-yl]phenyl ether
Formula:
C24H22ClN3O
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 403.9 g/mol |
|---|---|
| XLogP3 | 6.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 6 |
| Exact Mass | 403.1451400 g/mol |
| Monoisotopic Mass | 403.1451400 g/mol |
| Topological Polar Surface Area | 46 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 577 |
| 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 |