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3008-60-4 | 5-((Dimethylamino)methyl)-4-phenyl-1,3-thiazol-2-amine
CAS No: 3008-60-4 Catalog No: AG01F837 MDL No:
Product Description
Catalog Number:
AG01F837
Chemical Name:
5-((Dimethylamino)methyl)-4-phenyl-1,3-thiazol-2-amine
CAS Number:
3008-60-4
Molecular Formula:
C12H15N3S
Molecular Weight:
233.3326
IUPAC Name:
5-[(dimethylamino)methyl]-4-phenyl-1,3-thiazol-2-amine
InChI:
InChI=1S/C12H15N3S/c1-15(2)8-10-11(14-12(13)16-10)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H2,13,14)
InChI Key:
ZOTMWVZHCSOBIA-UHFFFAOYSA-N
SMILES:
CN(Cc1sc(nc1c1ccccc1)N)C
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.099g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.333g/mol
Monoisotopic Mass:
233.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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