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1-(2,4-dichlorobenzoyl)-3-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]thiourea

1-(2,4-dichlorobenzoyl)-3-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]thiourea

Formula: C24H19Cl2N3O2S

SMILES: CCC1=CC=C2OC(=NC2=C1)C1=CC=C(C)C(NC(=S)NC(=O)C2=CC=C(Cl)C=C2Cl)=C1

IUPAC: 1-(2,4-dichlorobenzoyl)-3-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]thiourea

InChI: InChI=1S/C24H19Cl2N3O2S/c1-3-14-5-9-21-20(10-14)27-23(31-21)15-6-4-13(2)19(11-15)28-24(32)29-22(30)17-8-7-16(25)12-18(17)26/h4-12H,3H2,1-2H3,(H2,28,29,30,32)

Composition: C (59.51%), H (3.95%), Cl (14.64%), N (8.67%), O (6.61%), S (6.62%)

Molar Mass: 484.4

Atom Count: 51

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 483.0575034
Formal Charge 0
FSP3 0.12
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey NYSGYQNEYZVJOW-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 143.88
Topological Polar Surface Area 67.16
Polarizability 52.06
Ring Count 4
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C24H19Cl2N3O2S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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