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4-benzyl-1-[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]piperidine

4-benzyl-1-[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]piperidine

Formula: C23H22Cl2N2O2

SMILES: CC1=C(C(=O)N2CCC(CC3=CC=CC=C3)CC2)C(=NO1)C1=C(Cl)C=CC=C1Cl

IUPAC: 4-benzyl-1-[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]piperidine

InChI: InChI=1S/C23H22Cl2N2O2/c1-15-20(22(26-29-15)21-18(24)8-5-9-19(21)25)23(28)27-12-10-17(11-13-27)14-16-6-3-2-4-7-16/h2-9,17H,10-14H2,1H3

Composition: C (64.34%), H (5.17%), Cl (16.51%), N (6.52%), O (7.45%)

Molar Mass: 429.34

Atom Count: 51

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 428.1058334
Formal Charge 0
FSP3 0.3
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey GMPOFZSSHIQTCN-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 117.28
Topological Polar Surface Area 46.34
Polarizability 45.47
Ring Count 4
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C23H22Cl2N2O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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