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Home > Pyridines > 338778-03-3
338778-03-3 | 4-(6-chloropyridin-2-yl)-N-phenylpiperazine-1-carboxamide
CAS No: 338778-03-3 Catalog No: AG00IR3N MDL No:MFCD00139010
Product Description
Catalog Number:
AG00IR3N
Chemical Name:
4-(6-chloropyridin-2-yl)-N-phenylpiperazine-1-carboxamide
CAS Number:
338778-03-3
Molecular Formula:
C16H17ClN4O
Molecular Weight:
316.7854
MDL Number:
MFCD00139010
IUPAC Name:
4-(6-chloropyridin-2-yl)-N-phenylpiperazine-1-carboxamide
InChI:
InChI=1S/C16H17ClN4O/c17-14-7-4-8-15(19-14)20-9-11-21(12-10-20)16(22)18-13-5-2-1-3-6-13/h1-8H,9-12H2,(H,18,22)
InChI Key:
PHQQLUVIGFEXPU-UHFFFAOYSA-N
SMILES:
Clc1cccc(n1)N1CCN(CC1)C(=O)Nc1ccccc1
Properties
Complexity:
367
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.109g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
316.789g/mol
Monoisotopic Mass:
316.109g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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