4-Boc-1-(3-bromopropyl)-2-piperazinone - CAS 2043000-92-4
Catalog: |
BB015916 |
Product Name: |
4-Boc-1-(3-bromopropyl)-2-piperazinone |
CAS: |
2043000-92-4 |
Synonyms: |
4-(3-bromopropyl)-3-oxo-1-piperazinecarboxylic acid tert-butyl ester; tert-butyl 4-(3-bromopropyl)-3-oxopiperazine-1-carboxylate |
IUPAC Name: | tert-butyl 4-(3-bromopropyl)-3-oxopiperazine-1-carboxylate |
Description: | 4-Boc-1-(3-bromopropyl)-2-piperazinone (CAS# 2043000-92-4 ) is a useful research chemical. |
Molecular Weight: | 321.21 |
Molecular Formula: | C12H21BrN2O3 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCN(C(=O)C1)CCCBr |
InChI: | InChI=1S/C12H21BrN2O3/c1-12(2,3)18-11(17)15-8-7-14(6-4-5-13)10(16)9-15/h4-9H2,1-3H3 |
InChI Key: | MGTUHPIXYWTSSI-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
EP-3292120-A1 | Tetrahydropyridopyrimidines and tetrahydropyridopyridines as inhibitors of hbsag (hbv surface antigen) and hbv dna production for the treatment of hepatitis b virus infections | 20150504 |
EP-3292120-B1 | Tetrahydropyridopyrimidines and tetrahydropyridopyridines as inhibitors of hbsag (hbv surface antigen) and hbv dna production for the treatment of hepatitis b virus infections | 20150504 |
JP-2018514575-A | Tetrahydropyridopyrimidines and tetrahydropyridopyridines as inhibitors of HBsAg (HBV surface antigen) and HBV DNA production for the treatment of hepatitis B virus infection | 20150504 |
JP-6462155-B2 | Tetrahydropyridopyrimidines and tetrahydropyridopyridines as inhibitors of HBsAg (HBV surface antigen) and HBV DNA production for the treatment of hepatitis B virus infection | 20150504 |
TW-201704233-A | Novel tetrahydropyridopyrimidine and tetrahydropyridinopyridine for the treatment and prevention of hepatitis B virus infection | 20150504 |
Complexity: | 315 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 320.07356 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 320.07356 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 49.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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