Home Carboxys 2,3-dihydro-2-oxo-1H-pyrido[2,3-b][1,4]thiazine-7-carboxylic acid

2,3-dihydro-2-oxo-1H-pyrido[2,3-b][1,4]thiazine-7-carboxylic acid

CAS No.:
443955-72-4
Catalog Number:
AG00DIKN
Molecular Formula:
C8H6N2O3S
Molecular Weight:
210.2098
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Product Description
Catalog Number:
AG00DIKN
Chemical Name:
2,3-dihydro-2-oxo-1H-pyrido[2,3-b][1,4]thiazine-7-carboxylic acid
CAS Number:
443955-72-4
Molecular Formula:
C8H6N2O3S
Molecular Weight:
210.2098
MDL Number:
MFCD18260664
IUPAC Name:
2-oxo-1H-pyrido[2,3-b][1,4]thiazine-7-carboxylic acid
InChI:
InChI=1S/C8H6N2O3S/c11-6-3-14-7-5(10-6)1-4(2-9-7)8(12)13/h1-2H,3H2,(H,10,11)(H,12,13)
InChI Key:
DIAWKFCBVNKMDH-UHFFFAOYSA-N
SMILES:
O=C1CSc2c(N1)cc(cn2)C(=O)O
Properties
Complexity:
271  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.01g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
210.207g/mol
Monoisotopic Mass:
210.01g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties