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Home > Aldehydes > 153196-63-5
153196-63-5 | 5-THIAZOLECARBOXALDEHYDE, 2-[2-[4-[BUTYL(1-METHYLPROPYL)AMINO]PHENYL]DIAZENYL]-4-METHOXY-
CAS No: 153196-63-5 Catalog No: AG007II2 MDL No:
Product Description
Catalog Number:
AG007II2
Chemical Name:
5-THIAZOLECARBOXALDEHYDE, 2-[2-[4-[BUTYL(1-METHYLPROPYL)AMINO]PHENYL]DIAZENYL]-4-METHOXY-
CAS Number:
153196-63-5
Molecular Formula:
C19H26N4O2S
Molecular Weight:
374.5003
IUPAC Name:
2-[[4-[butan-2-yl(butyl)amino]phenyl]diazenyl]-4-methoxy-1,3-thiazole-5-carbaldehyde
InChI:
InChI=1S/C19H26N4O2S/c1-5-7-12-23(14(3)6-2)16-10-8-15(9-11-16)21-22-19-20-18(25-4)17(13-24)26-19/h8-11,13-14H,5-7,12H2,1-4H3
InChI Key:
SUMIFAWDVMTGRK-UHFFFAOYSA-N
SMILES:
CCCCN(c1ccc(cc1)N=Nc1nc(c(s1)C=O)OC)C(CC)C
Properties
Complexity:
443
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.178g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
374.503g/mol
Monoisotopic Mass:
374.178g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
95.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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