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102432-74-6 | Benzenemethanamine, 4-chloro-N-[2-(1H-imidazol-1-ylmethyl)phenyl]-
CAS No: 102432-74-6 Catalog No: AG0007FP MDL No:
Product Description
Catalog Number:
AG0007FP
Chemical Name:
Benzenemethanamine, 4-chloro-N-[2-(1H-imidazol-1-ylmethyl)phenyl]-
CAS Number:
102432-74-6
Molecular Formula:
C17H16ClN3
Molecular Weight:
297.7820
IUPAC Name:
N-[(4-chlorophenyl)methyl]-2-(imidazol-1-ylmethyl)aniline
InChI:
InChI=1S/C17H16ClN3/c18-16-7-5-14(6-8-16)11-20-17-4-2-1-3-15(17)12-21-10-9-19-13-21/h1-10,13,20H,11-12H2
InChI Key:
XSEISCCZWTVSRP-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)CNc1ccccc1Cn1ccnc1
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.103g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
297.786g/mol
Monoisotopic Mass:
297.103g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
Literature
| Title | Journal |
|---|---|
| Selective antiviral activity of synthetic soluble L-tyrosine and L-dopa melanins against human immunodeficiency virus in vitro. | Antiviral research 19910101 |
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