Home Aldehydes 2-(piperidin-1-yl)-4-(thiophen-2-yl)-1,3-thiazole-5-carbaldehyde

2-(piperidin-1-yl)-4-(thiophen-2-yl)-1,3-thiazole-5-carbaldehyde

CAS No.:
554439-45-1
Catalog Number:
AG00I9WC
Molecular Formula:
C13H14N2OS2
Molecular Weight:
278.3931
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Product Description
Catalog Number:
AG00I9WC
Chemical Name:
2-(piperidin-1-yl)-4-(thiophen-2-yl)-1,3-thiazole-5-carbaldehyde
CAS Number:
554439-45-1
Molecular Formula:
C13H14N2OS2
Molecular Weight:
278.3931
MDL Number:
MFCD03988529
IUPAC Name:
2-piperidin-1-yl-4-thiophen-2-yl-1,3-thiazole-5-carbaldehyde
InChI:
InChI=1S/C13H14N2OS2/c16-9-11-12(10-5-4-8-17-10)14-13(18-11)15-6-2-1-3-7-15/h4-5,8-9H,1-3,6-7H2
InChI Key:
WYNISQYKXXYJSY-UHFFFAOYSA-N
SMILES:
O=Cc1sc(nc1c1cccs1)N1CCCCC1
Properties
Complexity:
297  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.055g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.388g/mol
Monoisotopic Mass:
278.055g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
89.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties