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887624-97-7 | 4-(4-phenyl-1,3-thiazol-2-yl)piperidine dihydrochloride
CAS No: 887624-97-7 Catalog No: AG01AGQE MDL No:MFCD18380624
Product Description
Catalog Number:
AG01AGQE
Chemical Name:
4-(4-phenyl-1,3-thiazol-2-yl)piperidine dihydrochloride
CAS Number:
887624-97-7
Molecular Formula:
C14H18Cl2N2S
Molecular Weight:
317.2771
MDL Number:
MFCD18380624
IUPAC Name:
4-phenyl-2-piperidin-4-yl-1,3-thiazole;dihydrochloride
InChI:
InChI=1S/C14H16N2S.2ClH/c1-2-4-11(5-3-1)13-10-17-14(16-13)12-6-8-15-9-7-12;;/h1-5,10,12,15H,6-9H2;2*1H
InChI Key:
ASBVVECHUDKEPQ-UHFFFAOYSA-N
SMILES:
N1CCC(CC1)c1scc(n1)c1ccccc1.Cl.Cl
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.057g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
317.272g/mol
Monoisotopic Mass:
316.057g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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