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Home > Thiazole > 1105604-40-7
1105604-40-7 | 1-(pyrrolidine-2-carbonyl)-4-(1,3-thiazol-2-yl)piperazine
CAS No: 1105604-40-7 Catalog No: AG01B47P MDL No:MFCD09805957
Product Description
Catalog Number:
AG01B47P
Chemical Name:
1-(pyrrolidine-2-carbonyl)-4-(1,3-thiazol-2-yl)piperazine
CAS Number:
1105604-40-7
Molecular Formula:
C12H18N4OS
Molecular Weight:
266.3625
MDL Number:
MFCD09805957
IUPAC Name:
pyrrolidin-2-yl-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
InChI:
InChI=1S/C12H18N4OS/c17-11(10-2-1-3-13-10)15-5-7-16(8-6-15)12-14-4-9-18-12/h4,9-10,13H,1-3,5-8H2
InChI Key:
WCQJTNNTCAJNEC-UHFFFAOYSA-N
SMILES:
O=C(N1CCN(CC1)c1nccs1)C1CCCN1
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.12g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
266.363g/mol
Monoisotopic Mass:
266.12g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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