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116544-88-8 | Methanone, (6-amino-2,3-dihydroimidazo[2,1-b]thiazol-5-yl)phenyl-
CAS No: 116544-88-8 Catalog No: AG000CQR MDL No:
Product Description
Catalog Number:
AG000CQR
Chemical Name:
Methanone, (6-amino-2,3-dihydroimidazo[2,1-b]thiazol-5-yl)phenyl-
CAS Number:
116544-88-8
Molecular Formula:
C12H11N3OS
Molecular Weight:
245.3002
IUPAC Name:
(6-amino-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-phenylmethanone
InChI:
InChI=1S/C12H11N3OS/c13-11-9(15-6-7-17-12(15)14-11)10(16)8-4-2-1-3-5-8/h1-5H,6-7,13H2
InChI Key:
PBLKOMAQHORAFR-UHFFFAOYSA-N
SMILES:
Nc1nc2n(c1C(=O)c1ccccc1)CCS2
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.062g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.3g/mol
Monoisotopic Mass:
245.062g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
86.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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