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19959-14-9 | 2-Thiazolamine, N-[[4-(dimethylamino)phenyl]methylene]-4-phenyl-
CAS No: 19959-14-9 Catalog No: AG002C73 MDL No:
Product Description
Catalog Number:
AG002C73
Chemical Name:
2-Thiazolamine, N-[[4-(dimethylamino)phenyl]methylene]-4-phenyl-
CAS Number:
19959-14-9
Molecular Formula:
C18H17N3S
Molecular Weight:
307.4127
IUPAC Name:
N,N-dimethyl-4-[(4-phenyl-1,3-thiazol-2-yl)iminomethyl]aniline
InChI:
InChI=1S/C18H17N3S/c1-21(2)16-10-8-14(9-11-16)12-19-18-20-17(13-22-18)15-6-4-3-5-7-15/h3-13H,1-2H3
InChI Key:
SHNJCBATXVDZCQ-UHFFFAOYSA-N
SMILES:
CN(c1ccc(cc1)C=Nc1scc(n1)c1ccccc1)C
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.114g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.415g/mol
Monoisotopic Mass:
307.114g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.4
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