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2-[1-(7-methoxy-1-benzofuran-2-carbonyl)piperidin-4-yl]-1,3-benzothiazole

2-[1-(7-methoxy-1-benzofuran-2-carbonyl)piperidin-4-yl]-1,3-benzothiazole

Formula: C22H20N2O3S

SMILES: COC1=C2OC(=CC2=CC=C1)C(=O)N1CCC(CC1)C1=NC2=CC=CC=C2S1

IUPAC: 2-[1-(7-methoxy-1-benzofuran-2-carbonyl)piperidin-4-yl]-1,3-benzothiazole

InChI: InChI=1S/C22H20N2O3S/c1-26-17-7-4-5-15-13-18(27-20(15)17)22(25)24-11-9-14(10-12-24)21-23-16-6-2-3-8-19(16)28-21/h2-8,13-14H,9-12H2,1H3

Composition: C (67.33%), H (5.14%), N (7.14%), O (12.23%), S (8.17%)

Molar Mass: 392.47

Atom Count: 48

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 392.119463686
Formal Charge 0
FSP3 0.27
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey WUAXQGGXNPJISM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 107.42
Topological Polar Surface Area 55.57
Polarizability 43.44
Ring Count 5
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H20N2O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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