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Home > Indoles and Oxindole > 1172989-88-6
1172989-88-6 | [2-(1-METHYL-2,3-DIHYDRO-1H-INDOL-5-YL)-2-(4-METHYLPIPERAZIN-1-YL)ETHYL]A+
CAS No: 1172989-88-6 Catalog No: AG01ARWL MDL No:MFCD11987148
Product Description
Catalog Number:
AG01ARWL
Chemical Name:
[2-(1-METHYL-2,3-DIHYDRO-1H-INDOL-5-YL)-2-(4-METHYLPIPERAZIN-1-YL)ETHYL]A+
CAS Number:
1172989-88-6
Molecular Formula:
C16H26N4
Molecular Weight:
274.4044
MDL Number:
MFCD11987148
IUPAC Name:
2-(1-methyl-2,3-dihydroindol-5-yl)-2-(4-methylpiperazin-1-yl)ethanamine
InChI:
InChI=1S/C16H26N4/c1-18-7-9-20(10-8-18)16(12-17)13-3-4-15-14(11-13)5-6-19(15)2/h3-4,11,16H,5-10,12,17H2,1-2H3
InChI Key:
UDXHGOKSBPIKSW-UHFFFAOYSA-N
SMILES:
NCC(c1ccc2c(c1)CCN2C)N1CCN(CC1)C
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.216g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
274.412g/mol
Monoisotopic Mass:
274.216g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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