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2-[4-(3,4-dichlorophenyl)piperazin-1-yl]-2-methylpropanamide

2-[4-(3,4-dichlorophenyl)piperazin-1-yl]-2-methylpropanamide

CAS: 256958-66-4

Formula: C14H19Cl2N3O

SMILES: CC(C)(N1CCN(CC1)C1=CC(Cl)=C(Cl)C=C1)C(N)=O

IUPAC: 2-[4-(3,4-dichlorophenyl)piperazin-1-yl]-2-methylpropanamide

InChI: InChI=1S/C14H19Cl2N3O/c1-14(2,13(17)20)19-7-5-18(6-8-19)10-3-4-11(15)12(16)9-10/h3-4,9H,5-8H2,1-2H3,(H2,17,20)

Composition: C (53.18%), H (6.06%), Cl (22.42%), N (13.29%), O (5.06%)

Molar Mass: 316.23

Atom Count: 39

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 315.0905176
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey GZJBFLPNACWIQB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 83.26
Topological Polar Surface Area 49.57
Polarizability 31.99
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 256958-66-4 $51.35-$86.31$51.35$63.37$86.31
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