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Home > Quinoline > 923604-68-6
923604-68-6 | 4-Quinolinol, 8-ethyl-7-methoxy-2-[4-(1-methylethyl)-2-thiazolyl]-
CAS No: 923604-68-6 Catalog No: AG0066Q5 MDL No:
Product Description
Catalog Number:
AG0066Q5
Chemical Name:
4-Quinolinol, 8-ethyl-7-methoxy-2-[4-(1-methylethyl)-2-thiazolyl]-
CAS Number:
923604-68-6
Molecular Formula:
C18H20N2O2S
Molecular Weight:
328.4286
IUPAC Name:
8-ethyl-7-methoxy-2-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-quinolin-4-one
InChI:
InChI=1S/C18H20N2O2S/c1-5-11-16(22-4)7-6-12-15(21)8-13(19-17(11)12)18-20-14(9-23-18)10(2)3/h6-10H,5H2,1-4H3,(H,19,21)
InChI Key:
BNXCXDUKKYBCBV-UHFFFAOYSA-N
SMILES:
CCc1c(OC)ccc2c1nc(cc2O)c1scc(n1)C(C)C
Properties
Complexity:
480
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.125g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
328.43g/mol
Monoisotopic Mass:
328.125g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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