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N-[2-({[(2-fluorophenyl)carbamoyl]methyl}sulfanyl)-1,3-benzothiazol-6-yl]-2-phenoxyacetamide

N-[2-({[(2-fluorophenyl)carbamoyl]methyl}sulfanyl)-1,3-benzothiazol-6-yl]-2-phenoxyacetamide

Formula: C23H18FN3O3S2

SMILES: FC1=CC=CC=C1NC(=O)CSC1=NC2=CC=C(NC(=O)COC3=CC=CC=C3)C=C2S1

IUPAC: N-[2-({[(2-fluorophenyl)carbamoyl]methyl}sulfanyl)-1,3-benzothiazol-6-yl]-2-phenoxyacetamide

InChI: InChI=1S/C23H18FN3O3S2/c24-17-8-4-5-9-18(17)26-22(29)14-31-23-27-19-11-10-15(12-20(19)32-23)25-21(28)13-30-16-6-2-1-3-7-16/h1-12H,13-14H2,(H,25,28)(H,26,29)

Composition: C (59.09%), H (3.88%), F (4.06%), N (8.99%), O (10.27%), S (13.71%)

Molar Mass: 467.53

Atom Count: 50

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 467.077361963
Formal Charge 0
FSP3 0.09
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey JDUVVOBMKJSGBP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 124.91
Topological Polar Surface Area 80.32
Polarizability 47.99
Ring Count 4
Rotatable Bond Count 8

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C23H18FN3O3S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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