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1-(4-tert-butylbenzoyl)-3-(2-chlorophenyl)thiourea

1-(4-tert-butylbenzoyl)-3-(2-chlorophenyl)thiourea

Formula: C18H19ClN2OS

SMILES: CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC1=CC=CC=C1Cl

IUPAC: 1-(4-tert-butylbenzoyl)-3-(2-chlorophenyl)thiourea

InChI: InChI=1S/C18H19ClN2OS/c1-18(2,3)13-10-8-12(9-11-13)16(22)21-17(23)20-15-7-5-4-6-14(15)19/h4-11H,1-3H3,(H2,20,21,22,23)

Composition: C (62.33%), H (5.52%), Cl (10.22%), N (8.08%), O (4.61%), S (9.24%)

Molar Mass: 346.87

Atom Count: 42

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 346.0906621
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 2
InChIKey BZPFKVOMVNJHDK-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 101.3
Topological Polar Surface Area 41.13
Polarizability 38.33
Ring Count 2
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H19ClN2OS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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