1-Boc-4-(2-nitrophenyl)piperazine - CAS 170017-73-9
Catalog: |
BB012598 |
Product Name: |
1-Boc-4-(2-nitrophenyl)piperazine |
CAS: |
170017-73-9 |
Synonyms: |
4-(2-nitrophenyl)-1-piperazinecarboxylic acid tert-butyl ester; tert-butyl 4-(2-nitrophenyl)piperazine-1-carboxylate |
IUPAC Name: | tert-butyl 4-(2-nitrophenyl)piperazine-1-carboxylate |
Description: | 1-Boc-4-(2-nitrophenyl)piperazine (CAS# 170017-73-9) is a useful research chemical. |
Molecular Weight: | 307.34 |
Molecular Formula: | C15H21N3O4 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=CC=C2[N+](=O)[O-] |
InChI: | InChI=1S/C15H21N3O4/c1-15(2,3)22-14(19)17-10-8-16(9-11-17)12-6-4-5-7-13(12)18(20)21/h4-7H,8-11H2,1-3H3 |
InChI Key: | GTGIZVUOLBRDAO-UHFFFAOYSA-N |
Boiling Point: | 436.457 °C at 760 mmHg |
Density: | 1.221 g/cm3 |
LogP: | 3.17800 |
Publication Number | Title | Priority Date |
EP-3538091-A1 | PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF | 20161108 |
US-10414727-B2 | Phenyl amino piperidine mTORC inhibitors and uses thereof | 20161108 |
US-2018127370-A1 | PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF | 20161108 |
US-2019389843-A1 | PYRROLE mTORC INHIBITORS AND USES THEREOF | 20161108 |
US-2020207716-A1 | PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF | 20161108 |
Complexity: | 408 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 307.15320616 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 307.15320616 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 78.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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