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88328-41-0 | Acetamide, N-[5-(1H-pyrrol-1-yl)-6-quinolinyl]-
CAS No: 88328-41-0 Catalog No: AG0047FO MDL No:
Product Description
Catalog Number:
AG0047FO
Chemical Name:
Acetamide, N-[5-(1H-pyrrol-1-yl)-6-quinolinyl]-
CAS Number:
88328-41-0
Molecular Formula:
C15H13N3O
Molecular Weight:
251.2832
IUPAC Name:
N-(5-pyrrol-1-ylquinolin-6-yl)acetamide
InChI:
InChI=1S/C15H13N3O/c1-11(19)17-14-7-6-13-12(5-4-8-16-13)15(14)18-9-2-3-10-18/h2-10H,1H3,(H,17,19)
InChI Key:
WFHWBRYSHREZBL-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc2c(c1n1cccc1)cccn2
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.106g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
251.289g/mol
Monoisotopic Mass:
251.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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