1,4-Bis(Boc)-2-piperazinemethanol - CAS 143540-05-0
Catalog: |
BB009619 |
Product Name: |
1,4-Bis(Boc)-2-piperazinemethanol |
CAS: |
143540-05-0 |
Synonyms: |
2-(hydroxymethyl)piperazine-1,4-dicarboxylic acid ditert-butyl ester; ditert-butyl 2-(hydroxymethyl)piperazine-1,4-dicarboxylate |
IUPAC Name: | ditert-butyl 2-(hydroxymethyl)piperazine-1,4-dicarboxylate |
Description: | 1,4-Bis(Boc)-2-piperazinemethanol (CAS# 143540-05-0) is a useful compound for the preparation of the LSD1 inhibitor. |
Molecular Weight: | 316.39 |
Molecular Formula: | C15H28N2O5 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCN(C(C1)CO)C(=O)OC(C)(C)C |
InChI: | InChI=1S/C15H28N2O5/c1-14(2,3)21-12(19)16-7-8-17(11(9-16)10-18)13(20)22-15(4,5)6/h11,18H,7-10H2,1-6H3 |
InChI Key: | TXCFQKQBPSGAKK-UHFFFAOYSA-N |
Appearance: | White to yellow solid |
MDL: | MFCD09908093 |
LogP: | 1.71090 |
Publication Number | Title | Priority Date |
EA-032698-B1 | 3-TETRAZOLYL-BENZENE-1,2-DISULPHONAMIDE DERIVATIVES AS METAL-β-LACTAMASE INHIBITORS | 20150626 |
US-10221163-B2 | Metallo-beta-lactamase inhibitors | 20150626 |
US-10544130-B2 | Metallo-beta-lactamase inhibitors | 20150626 |
US-2018244656-A1 | Metallo-beta-lactamase inhibitors | 20150626 |
US-2019144432-A1 | Metallo-beta-lactamase inhibitors | 20150626 |
Complexity: | 411 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 316.199822 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 316.199822 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 79.3 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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