(1S,4S)-(-)-2-(4-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane hydrobromide - CAS 308103-49-3
Catalog: |
BB020733 |
Product Name: |
(1S,4S)-(-)-2-(4-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane hydrobromide |
CAS: |
308103-49-3 |
Synonyms: |
(1S,4S)-2-(4-fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane;hydrobromide |
IUPAC Name: | (1S,4S)-2-(4-fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane;hydrobromide |
Description: | (1S,4S)-(-)-2-(4-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane hydrobromide (CAS# 308103-49-3 ) is a useful research chemical. |
Molecular Weight: | 273.14 |
Molecular Formula: | C11H13FN2 · HBr |
Canonical SMILES: | C1C2CNC1CN2C3=CC=C(C=C3)F.Br |
InChI: | InChI=1S/C11H13FN2.BrH/c12-8-1-3-10(4-2-8)14-7-9-5-11(14)6-13-9;/h1-4,9,11,13H,5-7H2;1H/t9-,11-;/m0./s1 |
InChI Key: | HDMUZFRUGPXOBN-ROLPUNSJSA-N |
Boiling Point: | 358.6 °C at 760 mmHg |
MDL: | MFCD01863505 |
LogP: | 2.72810 |
Publication Number | Title | Priority Date |
WO-2014086453-A1 | Azaheterobicyclic compounds | 20121207 |
JP-2006523704-A | Modulators of chemokine receptor active heterocyclic cyclopentyltetrahydroisoquinoline and tetrahydropyridopyridine | 20030417 |
Complexity: | 213 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 272.03244 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 272.03244 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 15.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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