Home Other Building Blocks 5-AMINO-1,2,3-THIADIAZOLE-N-PHENOXYCARBONYL-4-CARBOXYLIC ACID ETHYL ESTER

5-AMINO-1,2,3-THIADIAZOLE-N-PHENOXYCARBONYL-4-CARBOXYLIC ACID ETHYL ESTER

CAS No.:
2037-81-2
Catalog Number:
AG003MCG
Molecular Formula:
C12H11N3O4S
Molecular Weight:
293.2984
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Product Description
Catalog Number:
AG003MCG
Chemical Name:
5-AMINO-1,2,3-THIADIAZOLE-N-PHENOXYCARBONYL-4-CARBOXYLIC ACID ETHYL ESTER
CAS Number:
2037-81-2
Molecular Formula:
C12H11N3O4S
Molecular Weight:
293.2984
MDL Number:
MFCD00100230
IUPAC Name:
ethyl 5-(phenoxycarbonylamino)thiadiazole-4-carboxylate
InChI:
InChI=1S/C12H11N3O4S/c1-2-18-11(16)9-10(20-15-14-9)13-12(17)19-8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H,13,17)
InChI Key:
FCPHNPRVMWSGSK-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nnsc1NC(=O)Oc1ccccc1
Properties
Complexity:
350  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.047g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
293.297g/mol
Monoisotopic Mass:
293.047g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties