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Home > Nitro Compounds > 329778-81-6
329778-81-6 | N-(2-nitrophenyl)-2-(4-phenylpiperazin-1-yl)acetamide
CAS No: 329778-81-6 Catalog No: AG00ISW9 MDL No:MFCD01784543
Product Description
Catalog Number:
AG00ISW9
Chemical Name:
N-(2-nitrophenyl)-2-(4-phenylpiperazin-1-yl)acetamide
CAS Number:
329778-81-6
Molecular Formula:
C18H20N4O3
Molecular Weight:
340.3764
MDL Number:
MFCD01784543
IUPAC Name:
N-(2-nitrophenyl)-2-(4-phenylpiperazin-1-yl)acetamide
InChI:
InChI=1S/C18H20N4O3/c23-18(19-16-8-4-5-9-17(16)22(24)25)14-20-10-12-21(13-11-20)15-6-2-1-3-7-15/h1-9H,10-14H2,(H,19,23)
InChI Key:
FTPSJHZTLGNCGE-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1[N+](=O)[O-])CN1CCN(CC1)c1ccccc1
Properties
Complexity:
454
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.154g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
340.383g/mol
Monoisotopic Mass:
340.154g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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