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3-(1-benzofuran-2-carbonyl)-1-(3-chloro-2-methylphenyl)thiourea

3-(1-benzofuran-2-carbonyl)-1-(3-chloro-2-methylphenyl)thiourea

Formula: C17H13ClN2O2S

SMILES: CC1=C(Cl)C=CC=C1NC(=S)NC(=O)C1=CC2=CC=CC=C2O1

IUPAC: 3-(1-benzofuran-2-carbonyl)-1-(3-chloro-2-methylphenyl)thiourea

InChI: InChI=1S/C17H13ClN2O2S/c1-10-12(18)6-4-7-13(10)19-17(23)20-16(21)15-9-11-5-2-3-8-14(11)22-15/h2-9H,1H3,(H2,19,20,21,23)

Composition: C (59.22%), H (3.80%), Cl (10.28%), N (8.12%), O (9.28%), S (9.30%)

Molar Mass: 344.81

Atom Count: 36

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 344.0386265
Formal Charge 0
FSP3 0.06
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 2
InChIKey JWEXNVSTLXDULB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 96.39
Topological Polar Surface Area 54.27
Polarizability 37.18
Ring Count 3
Rotatable Bond Count 2

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H13ClN2O2S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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