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25021-78-7 | 4-(5-methyl-2-phenyl-1,3-thiazol-4-yl)aniline
CAS No: 25021-78-7 Catalog No: AG00VS92 MDL No:MFCD09882128
Product Description
Catalog Number:
AG00VS92
Chemical Name:
4-(5-methyl-2-phenyl-1,3-thiazol-4-yl)aniline
CAS Number:
25021-78-7
Molecular Formula:
C16H14N2S
Molecular Weight:
266.3608
MDL Number:
MFCD09882128
IUPAC Name:
4-(5-methyl-2-phenyl-1,3-thiazol-4-yl)aniline
InChI:
InChI=1S/C16H14N2S/c1-11-15(12-7-9-14(17)10-8-12)18-16(19-11)13-5-3-2-4-6-13/h2-10H,17H2,1H3
InChI Key:
PDMCPSUSTWCBSB-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)c1nc(sc1C)c1ccccc1
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.088g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
266.362g/mol
Monoisotopic Mass:
266.088g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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