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N-[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2-(3-methylphenoxy)acetamide

N-[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2-(3-methylphenoxy)acetamide

Formula: C23H20N2O2S

SMILES: CC1=CC=CC(OCC(=O)NC2=CC(=CC=C2C)C2=NC3=CC=CC=C3S2)=C1

IUPAC: N-[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2-(3-methylphenoxy)acetamide

InChI: InChI=1S/C23H20N2O2S/c1-15-6-5-7-18(12-15)27-14-22(26)24-20-13-17(11-10-16(20)2)23-25-19-8-3-4-9-21(19)28-23/h3-13H,14H2,1-2H3,(H,24,26)

Composition: C (71.11%), H (5.19%), N (7.21%), O (8.24%), S (8.25%)

Molar Mass: 388.49

Atom Count: 48

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 388.124549066
Formal Charge 0
FSP3 0.13
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey NRYRMQSDAJGVGX-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 123.14
Topological Polar Surface Area 51.22
Polarizability 44.61
Ring Count 4
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C23H20N2O2S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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