Home Carboxys ethyl 5-amino-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carboxylate

ethyl 5-amino-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carboxylate

CAS No.:
112267-06-8
Catalog Number:
AG01A3LP
Molecular Formula:
C9H10N4O2S
Molecular Weight:
238.2663
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Product Description
Catalog Number:
AG01A3LP
Chemical Name:
ethyl 5-amino-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carboxylate
CAS Number:
112267-06-8
Molecular Formula:
C9H10N4O2S
Molecular Weight:
238.2663
MDL Number:
MFCD22741308
IUPAC Name:
ethyl 5-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxylate
InChI:
InChI=1S/C9H10N4O2S/c1-2-15-8(14)6-5-12-13(7(6)10)9-11-3-4-16-9/h3-5H,2,10H2,1H3
InChI Key:
REXGBNCZFZQRSW-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnn(c1N)c1nccs1
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.052g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
238.265g/mol
Monoisotopic Mass:
238.052g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties