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(2E)-3-(2,4-dichlorophenyl)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]prop-2-en-1-one

(2E)-3-(2,4-dichlorophenyl)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]prop-2-en-1-one

Formula: C21H22Cl2N2O

SMILES: CC1=C(C)C(=CC=C1)N1CCN(CC1)C(=O)C=CC1=CC=C(Cl)C=C1Cl

IUPAC: (2E)-3-(2,4-dichlorophenyl)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]prop-2-en-1-one

InChI: InChI=1S/C21H22Cl2N2O/c1-15-4-3-5-20(16(15)2)24-10-12-25(13-11-24)21(26)9-7-17-6-8-18(22)14-19(17)23/h3-9,14H,10-13H2,1-2H3/b9-7+

Composition: C (64.79%), H (5.70%), Cl (18.21%), N (7.20%), O (4.11%)

Molar Mass: 389.32

Atom Count: 48

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 388.1109187
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey WZCHVJDJGXCWPU-VQHVLOKHSA-N
Lipinski's Rule of Five
Molar Refractivity 110.92
Topological Polar Surface Area 23.55
Polarizability 41.45
Ring Count 3
Rotatable Bond Count 3

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H22Cl2N2O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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