1-(4-Pyridylmethyl)piperazine - CAS 62089-74-1
Catalog: |
BB031411 |
Product Name: |
1-(4-Pyridylmethyl)piperazine |
CAS: |
62089-74-1 |
Synonyms: |
1-(pyridin-4-ylmethyl)piperazine; 1-(pyridin-4-ylmethyl)piperazine |
IUPAC Name: | 1-(pyridin-4-ylmethyl)piperazine |
Description: | 1-(4-Pyridylmethyl)piperazine (CAS# 62089-74-1) is used in the synthesis of cathespin B inhibitors. Also used in the synthesis of piperidine/piperazine derivatives as CCR5 antagonist-based HIV-1 inhibitors. |
Molecular Weight: | 177.25 |
Molecular Formula: | C10H15N3 |
Canonical SMILES: | C1CN(CCN1)CC2=CC=NC=C2 |
InChI: | InChI=1S/C10H15N3/c1-3-11-4-2-10(1)9-13-7-5-12-6-8-13/h1-4,12H,5-9H2 |
InChI Key: | XZYLSJPLCLKCMR-UHFFFAOYSA-N |
Boiling Point: | 68 ℃ / 0.15 mmHg |
Density: | 1.073 g/cm3 |
MDL: | MFCD01320892 |
LogP: | 0.75350 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112191273-A | High-entropy coordination polymer catalyst for oxygen production by electrolyzing water and preparation method and application thereof | 20201012 |
CN-110615774-A | Benzyl piperazine compound with anti-inflammatory activity, preparation method and medical application | 20190919 |
WO-2020206213-A1 | Method of inhibiting trem-1 | 20190403 |
US-2020247785-A1 | IL-17 Ligands And Uses Thereof | 20190206 |
WO-2020163554-A1 | Il-17a modulators and uses thereof | 20190206 |
Complexity: | 137 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 177.126597491 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 177.126597491 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 28.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0 |
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Pyridines
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