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3-methyl-1-{4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-yl}butan-1-one

3-methyl-1-{4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-yl}butan-1-one

Formula: C19H30N2O4

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

IUPAC: 3-methyl-1-{4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-yl}butan-1-one

InChI: InChI=1S/C19H30N2O4/c1-14(2)10-19(22)21-8-6-20(7-9-21)13-15-11-17(24-4)18(25-5)12-16(15)23-3/h11-12,14H,6-10,13H2,1-5H3

Composition: C (65.12%), H (8.63%), N (7.99%), O (18.26%)

Molar Mass: 350.459

Atom Count: 55

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 350.220557454
Formal Charge 0
FSP3 0.63
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey GXHLDVYKAHPANX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 98.09
Topological Polar Surface Area 51.24
Polarizability 38.3
Ring Count 2
Rotatable Bond Count 7

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C19H30N2O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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