N-(4-Bromophenyl)-3-phenylpropanamide - CAS 316146-27-7
Catalog: |
BB021000 |
Product Name: |
N-(4-Bromophenyl)-3-phenylpropanamide |
CAS: |
316146-27-7 |
Synonyms: |
N-(4-bromophenyl)-3-phenylpropanamide; N-(4-bromophenyl)-3-phenylpropanamide |
IUPAC Name: | N-(4-bromophenyl)-3-phenylpropanamide |
Description: | N-(4-Bromophenyl)-3-phenylpropanamide (CAS# 316146-27-7) is a reactant used in the preparation of quinoline derivatives as antitubercular agent and antibacterial agents. |
Molecular Weight: | 304.18 |
Molecular Formula: | C15H14BrNO |
Canonical SMILES: | C1=CC=C(C=C1)CCC(=O)NC2=CC=C(C=C2)Br |
InChI: | InChI=1S/C15H14BrNO/c16-13-7-9-14(10-8-13)17-15(18)11-6-12-4-2-1-3-5-12/h1-5,7-10H,6,11H2,(H,17,18) |
InChI Key: | HGPWLPIFXDCULJ-UHFFFAOYSA-N |
Boiling Point: | 473.2 °C at 760 mmHg |
Density: | 1.408 g/cm3 |
LogP: | 4.09340 |
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Complexity: | 255 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 303.02588 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 303.02588 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 29.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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