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1170466-71-3 | [2-(4-METHYLPIPERAZIN-1-YL)-2-(1-METHYL-1,2,3,4-TETRAHYDROQUINOLIN-6-YL)E+
CAS No: 1170466-71-3 Catalog No: AG01ARXE MDL No:MFCD11987149
Product Description
Catalog Number:
AG01ARXE
Chemical Name:
[2-(4-METHYLPIPERAZIN-1-YL)-2-(1-METHYL-1,2,3,4-TETRAHYDROQUINOLIN-6-YL)E+
CAS Number:
1170466-71-3
Molecular Formula:
C17H28N4
Molecular Weight:
288.4310
MDL Number:
MFCD11987149
IUPAC Name:
2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-(4-methylpiperazin-1-yl)ethanamine
InChI:
InChI=1S/C17H28N4/c1-19-8-10-21(11-9-19)17(13-18)15-5-6-16-14(12-15)4-3-7-20(16)2/h5-6,12,17H,3-4,7-11,13,18H2,1-2H3
InChI Key:
QANTUAMJUURSML-UHFFFAOYSA-N
SMILES:
NCC(c1ccc2c(c1)CCCN2C)N1CCN(CC1)C
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.231g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
288.439g/mol
Monoisotopic Mass:
288.231g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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