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3-[2-chloro-5-(trifluoromethyl)phenyl]-1-(naphthalene-1-carbonyl)thiourea

3-[2-chloro-5-(trifluoromethyl)phenyl]-1-(naphthalene-1-carbonyl)thiourea

Formula: C19H12ClF3N2OS

SMILES: FC(F)(F)C1=CC=C(Cl)C(NC(=S)NC(=O)C2=CC=CC3=CC=CC=C23)=C1

IUPAC: 3-[2-chloro-5-(trifluoromethyl)phenyl]-1-(naphthalene-1-carbonyl)thiourea

InChI: InChI=1S/C19H12ClF3N2OS/c20-15-9-8-12(19(21,22)23)10-16(15)24-18(27)25-17(26)14-7-3-5-11-4-1-2-6-13(11)14/h1-10H,(H2,24,25,26,27)

Composition: C (55.82%), H (2.96%), Cl (8.67%), F (13.94%), N (6.85%), O (3.91%), S (7.84%)

Molar Mass: 408.82

Atom Count: 39

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 408.0310964
Formal Charge 0
FSP3 0.05
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 2
InChIKey HJEFRIGDNNLJDF-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 105.05
Topological Polar Surface Area 41.13
Polarizability 39.5
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 C19H12ClF3N2OS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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