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89405-38-9 | Phenol, 2-methoxy-4-[[[4-(4-methoxyphenyl)-2-thiazolyl]imino]methyl]-
CAS No: 89405-38-9 Catalog No: AG003VT4 MDL No:
Product Description
Catalog Number:
AG003VT4
Chemical Name:
Phenol, 2-methoxy-4-[[[4-(4-methoxyphenyl)-2-thiazolyl]imino]methyl]-
CAS Number:
89405-38-9
Molecular Formula:
C18H16N2O3S
Molecular Weight:
340.3962
IUPAC Name:
2-methoxy-4-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]iminomethyl]phenol
InChI:
InChI=1S/C18H16N2O3S/c1-22-14-6-4-13(5-7-14)15-11-24-18(20-15)19-10-12-3-8-16(21)17(9-12)23-2/h3-11,21H,1-2H3
InChI Key:
KCTGHNBMFTUQAS-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1csc(n1)N=Cc1ccc(c(c1)OC)O
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.088g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
340.397g/mol
Monoisotopic Mass:
340.088g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
92.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.8
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