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312278-95-8 | N-(2,3-Dimethyl-phenyl)-2-(4-phenyl-1H-imidazol-2-ylsulfanyl)-acetamide
CAS No: 312278-95-8 Catalog No: AG01F4VM MDL No:
Product Description
Catalog Number:
AG01F4VM
Chemical Name:
N-(2,3-Dimethyl-phenyl)-2-(4-phenyl-1H-imidazol-2-ylsulfanyl)-acetamide
CAS Number:
312278-95-8
Molecular Formula:
C19H19N3OS
Molecular Weight:
337.4387
IUPAC Name:
N-(2,3-dimethylphenyl)-2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]acetamide
InChI:
InChI=1S/C19H19N3OS/c1-13-7-6-10-16(14(13)2)21-18(23)12-24-19-20-11-17(22-19)15-8-4-3-5-9-15/h3-11H,12H2,1-2H3,(H,20,22)(H,21,23)
InChI Key:
MVBJAPWJNOFGMS-UHFFFAOYSA-N
SMILES:
O=C(Nc1cccc(c1C)C)CSc1[nH]cc(n1)c1ccccc1
Properties
Complexity:
413
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.125g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
337.441g/mol
Monoisotopic Mass:
337.125g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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