1-Boc-3-(4-amino-1-pyrazolyl)azetidine - CAS 1029413-51-1
Catalog: |
BB000970 |
Product Name: |
1-Boc-3-(4-amino-1-pyrazolyl)azetidine |
CAS: |
1029413-51-1 |
Synonyms: |
3-(4-amino-1-pyrazolyl)-1-azetidinecarboxylic acid tert-butyl ester; tert-butyl 3-(4-aminopyrazol-1-yl)azetidine-1-carboxylate |
IUPAC Name: | tert-butyl 3-(4-aminopyrazol-1-yl)azetidine-1-carboxylate |
Description: | 1-Boc-3-(4-amino-1-pyrazolyl)azetidine (CAS# 1029413-51-1) is a pyrazolamine derivative that can be prepared by alkylation of nitropyrazole with alcohol and subsequent reduction. |
Molecular Weight: | 238.29 |
Molecular Formula: | C11H18N4O2 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CC(C1)N2C=C(C=N2)N |
InChI: | InChI=1S/C11H18N4O2/c1-11(2,3)17-10(16)14-6-9(7-14)15-5-8(12)4-13-15/h4-5,9H,6-7,12H2,1-3H3 |
InChI Key: | JYDHOTMQNGXWGO-UHFFFAOYSA-N |
MDL: | MFCD10687122 |
LogP: | 1.77620 |
Publication Number | Title | Priority Date |
WO-2021168521-A1 | Inhibitors of necroptosis | 20200227 |
US-2021198280-A1 | Bifunctional compounds for degrading btk via ubiquitin proteosome pathway | 20191204 |
WO-2021113557-A1 | Bifunctional compounds for degrading btk via ubiquitin proteosome pathway | 20191204 |
WO-2021069721-A1 | Atf6 modulators and uses thereof | 20191009 |
WO-2020119819-A1 | Benzamides of pyrazolyl-amino-pyrimidinyl derivatives, and compositions and methods thereof | 20181214 |
Complexity: | 296 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 238.14297583 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 238.14297583 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 73.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.2 |
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Azetidines
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