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1000932-25-1 | 2-[(5-methyl-1,3-thiazol-2-yl)sulfanyl]-1-(thiophen-2-yl)ethan-1-one
CAS No: 1000932-25-1 Catalog No: AG019LDM MDL No:MFCD09971368
Product Description
Catalog Number:
AG019LDM
Chemical Name:
2-[(5-methyl-1,3-thiazol-2-yl)sulfanyl]-1-(thiophen-2-yl)ethan-1-one
CAS Number:
1000932-25-1
Molecular Formula:
C10H9NOS3
Molecular Weight:
255.3796
MDL Number:
MFCD09971368
IUPAC Name:
2-[(5-methyl-1,3-thiazol-2-yl)sulfanyl]-1-thiophen-2-ylethanone
InChI:
InChI=1S/C10H9NOS3/c1-7-5-11-10(15-7)14-6-8(12)9-3-2-4-13-9/h2-5H,6H2,1H3
InChI Key:
VDWGCRBGGHJQLA-UHFFFAOYSA-N
SMILES:
Cc1cnc(s1)SCC(=O)c1cccs1
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.985g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.368g/mol
Monoisotopic Mass:
254.985g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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