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88048-55-9 | Benzenamine, 2-(2,2-di-1H-indol-3-ylethyl)-N-ethyl-
CAS No: 88048-55-9 Catalog No: AG004IX4 MDL No:
Product Description
Catalog Number:
AG004IX4
Chemical Name:
Benzenamine, 2-(2,2-di-1H-indol-3-ylethyl)-N-ethyl-
CAS Number:
88048-55-9
Molecular Formula:
C26H25N3
Molecular Weight:
379.4968
IUPAC Name:
2-[2,2-bis(1H-indol-3-yl)ethyl]-N-ethylaniline
InChI:
InChI=1S/C26H25N3/c1-2-27-24-12-6-3-9-18(24)15-21(22-16-28-25-13-7-4-10-19(22)25)23-17-29-26-14-8-5-11-20(23)26/h3-14,16-17,21,27-29H,2,15H2,1H3
InChI Key:
NYHTWBVHAJJDJA-UHFFFAOYSA-N
SMILES:
CCNc1ccccc1CC(c1c[nH]c2c1cccc2)c1c[nH]c2c1cccc2
Properties
Complexity:
490
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
379.205g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
379.507g/mol
Monoisotopic Mass:
379.205g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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