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1431965-24-0 | 1-(4-methyl-2-{[(oxolan-2-yl)methyl]amino}-1,3-thiazol-5-yl)ethan-1-one hydrochloride
CAS No: 1431965-24-0 Catalog No: AG01FJA6 MDL No:
Product Description
Catalog Number:
AG01FJA6
Chemical Name:
1-(4-methyl-2-{[(oxolan-2-yl)methyl]amino}-1,3-thiazol-5-yl)ethan-1-one hydrochloride
CAS Number:
1431965-24-0
Molecular Formula:
C11H17ClN2O2S
Molecular Weight:
276.7829
IUPAC Name:
1-[4-methyl-2-(oxolan-2-ylmethylamino)-1,3-thiazol-5-yl]ethanone;hydrochloride
InChI:
InChI=1S/C11H16N2O2S.ClH/c1-7-10(8(2)14)16-11(13-7)12-6-9-4-3-5-15-9;/h9H,3-6H2,1-2H3,(H,12,13);1H
InChI Key:
YSXMNNLUVKAPJO-UHFFFAOYSA-N
SMILES:
CC(=O)c1sc(nc1C)NCC1CCCO1.Cl
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.07g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
276.779g/mol
Monoisotopic Mass:
276.07g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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