Home Carboxys 2-[(pyridin-2-yl)amino]-1,3-thiazole-4-carboxylic acid

2-[(pyridin-2-yl)amino]-1,3-thiazole-4-carboxylic acid

CAS No.:
232596-44-0
Catalog Number:
AG01AIE6
Molecular Formula:
C9H7N3O2S
Molecular Weight:
221.2358
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Product Description
Catalog Number:
AG01AIE6
Chemical Name:
2-[(pyridin-2-yl)amino]-1,3-thiazole-4-carboxylic acid
CAS Number:
232596-44-0
Molecular Formula:
C9H7N3O2S
Molecular Weight:
221.2358
MDL Number:
MFCD19686227
IUPAC Name:
2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxylic acid
InChI:
InChI=1S/C9H7N3O2S/c13-8(14)6-5-15-9(11-6)12-7-3-1-2-4-10-7/h1-5H,(H,13,14)(H,10,11,12)
InChI Key:
BPCKVRSSTCYOCV-UHFFFAOYSA-N
SMILES:
OC(=O)c1csc(n1)Nc1ccccn1
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.026g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
221.234g/mol
Monoisotopic Mass:
221.026g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties