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87866-85-1 | 1H-Indol-1-amine, N-[[4-(diphenylamino)phenyl]methylene]-2,3-dihydro-
CAS No: 87866-85-1 Catalog No: AG004EE4 MDL No:
Product Description
Catalog Number:
AG004EE4
Chemical Name:
1H-Indol-1-amine, N-[[4-(diphenylamino)phenyl]methylene]-2,3-dihydro-
CAS Number:
87866-85-1
Molecular Formula:
C27H23N3
Molecular Weight:
389.4916
IUPAC Name:
4-(2,3-dihydroindol-1-yliminomethyl)-N,N-diphenylaniline
InChI:
InChI=1S/C27H23N3/c1-3-10-24(11-4-1)30(25-12-5-2-6-13-25)26-17-15-22(16-18-26)21-28-29-20-19-23-9-7-8-14-27(23)29/h1-18,21H,19-20H2
InChI Key:
BDOREOQUMBEBEA-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)N(c1ccccc1)c1ccc(cc1)C=NN1CCc2c1cccc2
Properties
Complexity:
522
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
389.189g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
389.502g/mol
Monoisotopic Mass:
389.189g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
18.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
6.9
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