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Home > Pyridines > 1311315-01-1
1311315-01-1 | 4-[2-(piperidin-4-yl)-1,3-thiazol-4-yl]pyridine dihydrochloride
CAS No: 1311315-01-1 Catalog No: AG01AGQA MDL No:MFCD18483173
Product Description
Catalog Number:
AG01AGQA
Chemical Name:
4-[2-(piperidin-4-yl)-1,3-thiazol-4-yl]pyridine dihydrochloride
CAS Number:
1311315-01-1
Molecular Formula:
C13H17Cl2N3S
Molecular Weight:
318.2652
MDL Number:
MFCD18483173
IUPAC Name:
2-piperidin-4-yl-4-pyridin-4-yl-1,3-thiazole;dihydrochloride
InChI:
InChI=1S/C13H15N3S.2ClH/c1-5-14-6-2-10(1)12-9-17-13(16-12)11-3-7-15-8-4-11;;/h1-2,5-6,9,11,15H,3-4,7-8H2;2*1H
InChI Key:
LVSRRXAFJGIWNC-UHFFFAOYSA-N
SMILES:
N1CCC(CC1)c1scc(n1)c1ccncc1.Cl.Cl
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.052g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
318.26g/mol
Monoisotopic Mass:
317.052g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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