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Home > Thiazole > 1955519-81-9
1955519-81-9 | 2-methyl-1-(1,3-thiazole-4-carbonyl)piperazine hydrochloride
CAS No: 1955519-81-9 Catalog No: AG01B4RK MDL No:MFCD30180949
Product Description
Catalog Number:
AG01B4RK
Chemical Name:
2-methyl-1-(1,3-thiazole-4-carbonyl)piperazine hydrochloride
CAS Number:
1955519-81-9
Molecular Formula:
C9H14ClN3OS
Molecular Weight:
247.7450
MDL Number:
MFCD30180949
IUPAC Name:
(2-methylpiperazin-1-yl)-(1,3-thiazol-4-yl)methanone;hydrochloride
InChI:
InChI=1S/C9H13N3OS.ClH/c1-7-4-10-2-3-12(7)9(13)8-5-14-6-11-8;/h5-7,10H,2-4H2,1H3;1H
InChI Key:
OLRHZFHVDGQNLH-UHFFFAOYSA-N
SMILES:
CC1CNCCN1C(=O)c1cscn1.Cl
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.055g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
247.741g/mol
Monoisotopic Mass:
247.055g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
73.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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