5-Boc-4,5,6,7-Tetrahydropyrazolo[4,3-c]pyridine - CAS 230301-11-8
Catalog: |
BB017873 |
Product Name: |
5-Boc-4,5,6,7-Tetrahydropyrazolo[4,3-c]pyridine |
CAS: |
230301-11-8 |
Synonyms: |
1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxylic acid tert-butyl ester; tert-butyl 1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxylate |
IUPAC Name: | tert-butyl 1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxylate |
Description: | 5-Boc-4,5,6,7-Tetrahydropyrazolo[4,3-c]pyridine (CAS# 230301-11-8) is a useful research chemical compound. |
Molecular Weight: | 223.27 |
Molecular Formula: | C11H17N3O2 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCC2=C(C1)C=NN2 |
InChI: | InChI=1S/C11H17N3O2/c1-11(2,3)16-10(15)14-5-4-9-8(7-14)6-12-13-9/h6H,4-5,7H2,1-3H3,(H,12,13) |
InChI Key: | BHYPERDTLBCHAE-UHFFFAOYSA-N |
Boiling Point: | 388 °C at 760 mmHg |
Density: | 1.2 g/cm3 |
MDL: | MFCD08059268 |
LogP: | 1.64080 |
GHS Hazard Statement: | H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
TW-202106685-A | Novel phenyl and pyridyl ureas active against the hepatitis b virus (hbv) | 20190430 |
TW-202106687-A | Novel indole-2-carboxamides active against the hepatitis b virus (hbv) | 20190430 |
WO-2020106560-A1 | Substituted amino triazolopyrimidine and amino triazolopyrazine adenosine receptor antagonists, pharmaceutical compositions and their use | 20181120 |
EP-3883576-A1 | Substituted amino triazolopyrimidine and amino triazolopyrazine adenosine receptor antagonists, pharmaceutical compositions and their use | 20181120 |
WO-2020094749-A1 | 5-[6-[[3-(4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-1-yl)azetidin-1-yl]methyl]morpholin-4-yl]quinoline-8-carbonitrile derivatives and similar compounds as tlr7-9 antagonists for treating systemic lupus erythematosus | 20181109 |
Complexity: | 275 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 223.132076794 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 223.132076794 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 58.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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