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62089-74-1 | 1-(4-Pyridylmethyl)piperazine
CAS No: 62089-74-1 Catalog No: AG0032IT MDL No:MFCD01320892
Product Description
Catalog Number:
AG0032IT
Chemical Name:
1-(4-Pyridylmethyl)piperazine
CAS Number:
62089-74-1
Molecular Formula:
C10H15N3
Molecular Weight:
177.2462
MDL Number:
MFCD01320892
IUPAC Name:
1-(pyridin-4-ylmethyl)piperazine
InChI:
InChI=1S/C10H15N3/c1-3-11-4-2-10(1)9-13-7-5-12-6-8-13/h1-4,12H,5-9H2
InChI Key:
XZYLSJPLCLKCMR-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)Cc1ccncc1
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.127g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.251g/mol
Monoisotopic Mass:
177.127g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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