Home Other Building Blocks ETHYL 4-AMINO-3-METHYLTHIENO[2,3-C]ISOTHIAZOLE-5-CARBOXYLATE

ETHYL 4-AMINO-3-METHYLTHIENO[2,3-C]ISOTHIAZOLE-5-CARBOXYLATE

CAS No.:
82000-54-2
Catalog Number:
AG00G7BY
Molecular Formula:
C9H10N2O2S2
Molecular Weight:
242.3179
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Product Description
Catalog Number:
AG00G7BY
Chemical Name:
ETHYL 4-AMINO-3-METHYLTHIENO[2,3-C]ISOTHIAZOLE-5-CARBOXYLATE
CAS Number:
82000-54-2
Molecular Formula:
C9H10N2O2S2
Molecular Weight:
242.3179
MDL Number:
MFCD00139775
IUPAC Name:
ethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate
InChI:
InChI=1S/C9H10N2O2S2/c1-3-13-9(12)7-6(10)5-4(2)15-11-8(5)14-7/h3,10H2,1-2H3
InChI Key:
WRIWXKCVJAGUIR-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1sc2c(c1N)c(sn2)C
Properties
Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.018g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
242.311g/mol
Monoisotopic Mass:
242.018g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties