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474417-23-7 | 1-(2-Thiazolyl)-4-(tert-butoxycarbonyl)piperazine
CAS No: 474417-23-7 Catalog No: AG00DHVN MDL No:
Product Description
Catalog Number:
AG00DHVN
Chemical Name:
1-(2-Thiazolyl)-4-(tert-butoxycarbonyl)piperazine
CAS Number:
474417-23-7
Molecular Formula:
C12H19N3O2S
Molecular Weight:
269.3632
IUPAC Name:
tert-butyl 4-(1,3-thiazol-2-yl)piperazine-1-carboxylate
InChI:
InChI=1S/C12H19N3O2S/c1-12(2,3)17-11(16)15-7-5-14(6-8-15)10-13-4-9-18-10/h4,9H,5-8H2,1-3H3
InChI Key:
NSVFGYBKPNLCIL-UHFFFAOYSA-N
SMILES:
O=C(N1CCN(CC1)c1nccs1)OC(C)(C)C
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.12g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.363g/mol
Monoisotopic Mass:
269.12g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
73.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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