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749151-25-5 | 4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]aniline
CAS No: 749151-25-5 Catalog No: AG00ICKO MDL No:MFCD09891631
Product Description
Catalog Number:
AG00ICKO
Chemical Name:
4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]aniline
CAS Number:
749151-25-5
Molecular Formula:
C16H14N2OS
Molecular Weight:
282.3602
MDL Number:
MFCD09891631
IUPAC Name:
4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]aniline
InChI:
InChI=1S/C16H14N2OS/c1-19-14-8-4-11(5-9-14)15-10-20-16(18-15)12-2-6-13(17)7-3-12/h2-10H,17H2,1H3
InChI Key:
FEJBCMDICNNALW-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1csc(n1)c1ccc(cc1)N
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.083g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
282.361g/mol
Monoisotopic Mass:
282.083g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
76.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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