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89440-12-0 | 1H-Imidazole, 1-[1-[(2,6-dichlorophenyl)thio]-2-methyl-2-phenylpropyl]-
CAS No: 89440-12-0 Catalog No: AG0043SC MDL No:
Product Description
Catalog Number:
AG0043SC
Chemical Name:
1H-Imidazole, 1-[1-[(2,6-dichlorophenyl)thio]-2-methyl-2-phenylpropyl]-
CAS Number:
89440-12-0
Molecular Formula:
C19H18Cl2N2S
Molecular Weight:
377.3306
IUPAC Name:
1-[1-(2,6-dichlorophenyl)sulfanyl-2-methyl-2-phenylpropyl]imidazole
InChI:
InChI=1S/C19H18Cl2N2S/c1-19(2,14-7-4-3-5-8-14)18(23-12-11-22-13-23)24-17-15(20)9-6-10-16(17)21/h3-13,18H,1-2H3
InChI Key:
LJPPGZLFNXYHKM-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1SC(C(c1ccccc1)(C)C)n1ccnc1)Cl
Properties
Complexity:
391
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
376.057g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
377.327g/mol
Monoisotopic Mass:
376.057g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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