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N-[3-fluoro-4-(4-phenylpiperazin-1-yl)phenyl]-2-(morpholin-4-yl)acetamide

N-[3-fluoro-4-(4-phenylpiperazin-1-yl)phenyl]-2-(morpholin-4-yl)acetamide

CAS: 692737-20-5

Formula: C22H27FN4O2

SMILES: FC1=C(C=CC(NC(=O)CN2CCOCC2)=C1)N1CCN(CC1)C1=CC=CC=C1

IUPAC: N-[3-fluoro-4-(4-phenylpiperazin-1-yl)phenyl]-2-(morpholin-4-yl)acetamide

InChI: InChI=1S/C22H27FN4O2/c23-20-16-18(24-22(28)17-25-12-14-29-15-13-25)6-7-21(20)27-10-8-26(9-11-27)19-4-2-1-3-5-19/h1-7,16H,8-15,17H2,(H,24,28)

Composition: C (66.31%), H (6.83%), F (4.77%), N (14.06%), O (8.03%)

Molar Mass: 398.482

Atom Count: 56

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 398.211804288
Formal Charge 0
FSP3 0.41
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey FWZOTNIGAMRXHS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 114.62
Topological Polar Surface Area 48.05
Polarizability 42.24
Ring Count 4
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 692737-20-5 $51.35-$86.31$51.35$63.37$86.31
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