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71064-67-0 | 4-(1H-PHENANTHRO[9,10-D]IMIDAZOL-2-YLIMINO)-1(4H)-NAPHTHALENONE
CAS No: 71064-67-0 Catalog No: AG005ES5 MDL No:
Product Description
Catalog Number:
AG005ES5
Chemical Name:
4-(1H-PHENANTHRO[9,10-D]IMIDAZOL-2-YLIMINO)-1(4H)-NAPHTHALENONE
CAS Number:
71064-67-0
Molecular Formula:
C25H15N3O
Molecular Weight:
373.4061
IUPAC Name:
4-(phenanthro[9,10-d]imidazol-2-ylideneamino)naphthalen-1-ol
InChI:
InChI=1S/C25H15N3O/c29-22-14-13-21(17-9-3-4-10-18(17)22)26-25-27-23-19-11-5-1-7-15(19)16-8-2-6-12-20(16)24(23)28-25/h1-14,29H
InChI Key:
HECKITLSTNKNJC-UHFFFAOYSA-N
SMILES:
O=C1C=CC(=Nc2nc3c([nH]2)c2ccccc2c2c3cccc2)c2c1cccc2
NSC Number:
342738
Properties
Complexity:
700
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
373.122g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
373.415g/mol
Monoisotopic Mass:
373.122g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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