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89314-48-7 | 2-Thiazolamine, N,N-diethyl-4-(3,4,5-trimethoxyphenyl)-
CAS No: 89314-48-7 Catalog No: AG003ZX5 MDL No:
Product Description
Catalog Number:
AG003ZX5
Chemical Name:
2-Thiazolamine, N,N-diethyl-4-(3,4,5-trimethoxyphenyl)-
CAS Number:
89314-48-7
Molecular Formula:
C16H22N2O3S
Molecular Weight:
322.4225
IUPAC Name:
N,N-diethyl-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine
InChI:
InChI=1S/C16H22N2O3S/c1-6-18(7-2)16-17-12(10-22-16)11-8-13(19-3)15(21-5)14(9-11)20-4/h8-10H,6-7H2,1-5H3
InChI Key:
OFDZASQJLWPWLD-UHFFFAOYSA-N
SMILES:
CCN(c1scc(n1)c1cc(OC)c(c(c1)OC)OC)CC
Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.135g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
322.423g/mol
Monoisotopic Mass:
322.135g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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