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1461708-74-6 | 5-(benzylsulfanyl)-3-ethyl-[1,2]oxazolo[5,4-b]pyridine
CAS No: 1461708-74-6 Catalog No: AG01A6NE MDL No:MFCD26407602
Product Description
Catalog Number:
AG01A6NE
Chemical Name:
5-(benzylsulfanyl)-3-ethyl-[1,2]oxazolo[5,4-b]pyridine
CAS Number:
1461708-74-6
Molecular Formula:
C15H14N2OS
Molecular Weight:
270.3495
MDL Number:
MFCD26407602
IUPAC Name:
5-benzylsulfanyl-3-ethyl-[1,2]oxazolo[5,4-b]pyridine
InChI:
InChI=1S/C15H14N2OS/c1-2-14-13-8-12(9-16-15(13)18-17-14)19-10-11-6-4-3-5-7-11/h3-9H,2,10H2,1H3
InChI Key:
KCQKUGZDWCUMLV-UHFFFAOYSA-N
SMILES:
CCc1noc2c1cc(SCc1ccccc1)cn2
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.083g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.35g/mol
Monoisotopic Mass:
270.083g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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