Home Carboxys 2-(pyrrolidin-1-yl)thieno[2,3-d][1,3]thiazole-5-carboxylic acid

2-(pyrrolidin-1-yl)thieno[2,3-d][1,3]thiazole-5-carboxylic acid

CAS No.:
1211505-49-5
Catalog Number:
AG01AFIG
Molecular Formula:
C10H10N2O2S2
Molecular Weight:
254.3286
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Product Description
Catalog Number:
AG01AFIG
Chemical Name:
2-(pyrrolidin-1-yl)thieno[2,3-d][1,3]thiazole-5-carboxylic acid
CAS Number:
1211505-49-5
Molecular Formula:
C10H10N2O2S2
Molecular Weight:
254.3286
MDL Number:
MFCD18453278
IUPAC Name:
2-pyrrolidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxylic acid
InChI:
InChI=1S/C10H10N2O2S2/c13-9(14)7-5-6-8(15-7)11-10(16-6)12-3-1-2-4-12/h5H,1-4H2,(H,13,14)
InChI Key:
SSIJREFNTJCFIQ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2c(s1)nc(s2)N1CCCC1
Properties
Complexity:
297  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.018g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
254.322g/mol
Monoisotopic Mass:
254.018g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties