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1-[(2-methoxyphenyl)methyl]-4-(3,4,5-trimethoxybenzoyl)piperazine

1-[(2-methoxyphenyl)methyl]-4-(3,4,5-trimethoxybenzoyl)piperazine

Formula: C22H28N2O5

SMILES: COC1=CC=CC=C1CN1CCN(CC1)C(=O)C1=CC(OC)=C(OC)C(OC)=C1

IUPAC: 1-[(2-methoxyphenyl)methyl]-4-(3,4,5-trimethoxybenzoyl)piperazine

InChI: InChI=1S/C22H28N2O5/c1-26-18-8-6-5-7-16(18)15-23-9-11-24(12-10-23)22(25)17-13-19(27-2)21(29-4)20(14-17)28-3/h5-8,13-14H,9-12,15H2,1-4H3

Composition: C (65.98%), H (7.05%), N (7.00%), O (19.98%)

Molar Mass: 400.475

Atom Count: 57

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 400.19982201
Formal Charge 0
FSP3 0.41
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 0
InChIKey DXHWXOWVCFRSHC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 111.45
Topological Polar Surface Area 60.47
Polarizability 42.84
Ring Count 3
Rotatable Bond Count 7

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H28N2O5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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