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146948-28-9 | Thiazolo[2,3-c][1,4]thiazine-8-carboxylic acid, 5,6-dihydro-3-[(methylamino)carbonyl]-, ethyl ester
CAS No: 146948-28-9 Catalog No: AG001EGT MDL No:
Product Description
Catalog Number:
AG001EGT
Chemical Name:
Thiazolo[2,3-c][1,4]thiazine-8-carboxylic acid, 5,6-dihydro-3-[(methylamino)carbonyl]-, ethyl ester
CAS Number:
146948-28-9
Molecular Formula:
C11H14N2O3S2
Molecular Weight:
286.3705
IUPAC Name:
ethyl 3-(methylcarbamoyl)-5,6-dihydro-[1,3]thiazolo[2,3-c][1,4]thiazine-8-carboxylate
InChI:
InChI=1S/C11H14N2O3S2/c1-3-16-11(15)8-10-13(4-5-17-8)7(6-18-10)9(14)12-2/h6H,3-5H2,1-2H3,(H,12,14)
InChI Key:
HOVBUHVKFAIXPT-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1=c2scc(n2CCS1)C(=O)NC
Properties
Complexity:
446
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.045g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.364g/mol
Monoisotopic Mass:
286.045g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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