904814-87-5
Product Name:
4-(2-CARBOXY-6-NITRO-PHENYL)-PIPERAZINE-1-CARBOXYLIC ACID TERTIER-BUTYL ESTER
Formula:
C16H21N3O6
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COMPUTED DESCRIPTORS
Molecular Weight | 351.35 g/mol |
---|---|
XLogP3 | 2.1 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 4 |
Exact Mass | 351.14303540 g/mol |
Monoisotopic Mass | 351.14303540 g/mol |
Topological Polar Surface Area | 116 Ų |
Heavy Atom Count | 25 |
Formal Charge | 0 |
Complexity | 519 |
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 |