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1-(3-chlorophenyl)-4-(3,4,5-triethoxybenzoyl)piperazine

1-(3-chlorophenyl)-4-(3,4,5-triethoxybenzoyl)piperazine

Formula: C23H29ClN2O4

SMILES: CCOC1=CC(=CC(OCC)=C1OCC)C(=O)N1CCN(CC1)C1=CC=CC(Cl)=C1

IUPAC: 1-(3-chlorophenyl)-4-(3,4,5-triethoxybenzoyl)piperazine

InChI: InChI=1S/C23H29ClN2O4/c1-4-28-20-14-17(15-21(29-5-2)22(20)30-6-3)23(27)26-12-10-25(11-13-26)19-9-7-8-18(24)16-19/h7-9,14-16H,4-6,10-13H2,1-3H3

Composition: C (63.81%), H (6.75%), Cl (8.19%), N (6.47%), O (14.78%)

Molar Mass: 432.95

Atom Count: 59

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 432.1815851
Formal Charge 0
FSP3 0.43
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey PMTRJMPUEGREJQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 119.92
Topological Polar Surface Area 51.24
Polarizability 45.5
Ring Count 3
Rotatable Bond Count 8

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C23H29ClN2O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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