1-Boc-3-phenylpiperazine - CAS 502649-25-4
Catalog: |
BB026982 |
Product Name: |
1-Boc-3-phenylpiperazine |
CAS: |
502649-25-4 |
Synonyms: |
3-phenyl-1-piperazinecarboxylic acid tert-butyl ester; tert-butyl 3-phenylpiperazine-1-carboxylate |
IUPAC Name: | tert-butyl 3-phenylpiperazine-1-carboxylate |
Description: | 1-Boc-3-phenylpiperazine (CAS# 502649-25-4) is a useful research reagent used in the preparation of piperazinylphenyl pyrrolotriazinamines as PI3Kδ inhibitors. |
Molecular Weight: | 262.35 |
Molecular Formula: | C15H22N2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCNC(C1)C2=CC=CC=C2 |
InChI: | InChI=1S/C15H22N2O2/c1-15(2,3)19-14(18)17-10-9-16-13(11-17)12-7-5-4-6-8-12/h4-8,13,16H,9-11H2,1-3H3 |
InChI Key: | HRRFJZULVYGVNJ-UHFFFAOYSA-N |
Boiling Point: | 371.4 °C at 760 mmHg |
Density: | 1.071 g/cm3 |
Appearance: | Yellowish powder |
MDL: | MFCD03840082 |
LogP: | 2.83470 |
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 |
WO-2020115501-A1 | Pharmaceutical compounds and their use as inhibitors of ubiquitin specific protease 19 (usp19) | 20181206 |
EP-3575287-A1 | Inhibitors of n-acylphosphatidylethanolamine phospholipase d (nape-pld) | 20180531 |
WO-2019229250-A1 | Inhibitors of n-acylphosphatidylethanolamine phospholipase d (nape-pld) | 20180531 |
BR-112020015449-A2 | COMPOUNDS, PHARMACEUTICAL COMPOSITION, AND METHODS OF TREATING OBESITY, TREATING INSULIN RESISTANCE, TREATING TYPE II DIABETES, TREATING MUSCLE ATROPHY AND REDUCING MUSCLE MASS LOSS IN AN INDIVIDUAL. | 20180131 |
EP-3475275-A1 | 3-aryl and heteroaryl substituted 5-trifluoromethyl oxadiazoles as histone deacetylase 6 (hdac6) inhibitors | 20160623 |
Complexity: | 306 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 262.168127949 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 262.168127949 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 41.6 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Piperazines
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS