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N-[3-(1,3-benzoxazol-2-yl)phenyl]-2-(benzylsulfanyl)acetamide

N-[3-(1,3-benzoxazol-2-yl)phenyl]-2-(benzylsulfanyl)acetamide

Formula: C22H18N2O2S

SMILES: O=C(CSCC1=CC=CC=C1)NC1=CC=CC(=C1)C1=NC2=CC=CC=C2O1

IUPAC: N-[3-(1,3-benzoxazol-2-yl)phenyl]-2-(benzylsulfanyl)acetamide

InChI: InChI=1S/C22H18N2O2S/c25-21(15-27-14-16-7-2-1-3-8-16)23-18-10-6-9-17(13-18)22-24-19-11-4-5-12-20(19)26-22/h1-13H,14-15H2,(H,23,25)

Composition: C (70.57%), H (4.85%), N (7.48%), O (8.55%), S (8.56%)

Molar Mass: 374.46

Atom Count: 45

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 374.108899002
Formal Charge 0
FSP3 0.09
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey KBBJIFNYXJJAEI-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 119.83
Topological Polar Surface Area 55.13
Polarizability 43.53
Ring Count 4
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H18N2O2S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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