Home Carboxys 2-(piperidin-4-yl)-1,3-thiazole-4-carboxylic acid dihydrochloride

2-(piperidin-4-yl)-1,3-thiazole-4-carboxylic acid dihydrochloride

CAS No.:
2060043-29-8
Catalog Number:
AG01BS41
Molecular Formula:
C9H14Cl2N2O2S
Molecular Weight:
285.1907
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Product Description
Catalog Number:
AG01BS41
Chemical Name:
2-(piperidin-4-yl)-1,3-thiazole-4-carboxylic acid dihydrochloride
CAS Number:
2060043-29-8
Molecular Formula:
C9H14Cl2N2O2S
Molecular Weight:
285.1907
MDL Number:
MFCD30536036
IUPAC Name:
2-piperidin-4-yl-1,3-thiazole-4-carboxylic acid;dihydrochloride
InChI:
InChI=1S/C9H12N2O2S.2ClH/c12-9(13)7-5-14-8(11-7)6-1-3-10-4-2-6;;/h5-6,10H,1-4H2,(H,12,13);2*1H
InChI Key:
NPDXDZBAELWBOS-UHFFFAOYSA-N
SMILES:
OC(=O)c1csc(n1)C1CCNCC1.Cl.Cl
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.015g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
285.183g/mol
Monoisotopic Mass:
284.015g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
90.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties