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3-(1-benzofuran-2-carbonyl)-1-(4-ethylphenyl)thiourea

3-(1-benzofuran-2-carbonyl)-1-(4-ethylphenyl)thiourea

Formula: C18H16N2O2S

SMILES: CCC1=CC=C(NC(=S)NC(=O)C2=CC3=CC=CC=C3O2)C=C1

IUPAC: 3-(1-benzofuran-2-carbonyl)-1-(4-ethylphenyl)thiourea

InChI: InChI=1S/C18H16N2O2S/c1-2-12-7-9-14(10-8-12)19-18(23)20-17(21)16-11-13-5-3-4-6-15(13)22-16/h3-11H,2H2,1H3,(H2,19,20,21,23)

Composition: C (66.65%), H (4.97%), N (8.64%), O (9.86%), S (9.88%)

Molar Mass: 324.4

Atom Count: 39

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 324.093248937
Formal Charge 0
FSP3 0.11
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 2
InChIKey PRNCLRHJGNYQIB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 96.19
Topological Polar Surface Area 54.27
Polarizability 37.18
Ring Count 3
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H16N2O2S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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