440332-52-5
Product Name:
ethyl 4-{[4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)phenyl]carbonyl}piperazine-1-carboxylate
Formula:
C21H21N5O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 407.4 g/mol |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 407.15935417 g/mol |
| Monoisotopic Mass | 407.15935417 g/mol |
| Topological Polar Surface Area | 94.9 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 683 |
| 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 |