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1086375-68-9 | Methyl 2-Amino-5-(2-furyl)-1,3-thiazole-4-carboxylate
CAS No: 1086375-68-9 Catalog No: AG01F85G MDL No:
Product Description
Catalog Number:
AG01F85G
Chemical Name:
Methyl 2-Amino-5-(2-furyl)-1,3-thiazole-4-carboxylate
CAS Number:
1086375-68-9
Molecular Formula:
C9H8N2O3S
Molecular Weight:
224.2364
IUPAC Name:
methyl 2-amino-5-(furan-2-yl)-1,3-thiazole-4-carboxylate
InChI:
InChI=1S/C9H8N2O3S/c1-13-8(12)6-7(15-9(10)11-6)5-3-2-4-14-5/h2-4H,1H3,(H2,10,11)
InChI Key:
WHHPTUBATUIJQU-UHFFFAOYSA-N
SMILES:
COC(=O)c1nc(sc1c1ccco1)N
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.026g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.234g/mol
Monoisotopic Mass:
224.026g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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