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17851-68-2 | 2-Naphthalenecarboxamide, 3-hydroxy-N-(4-methoxyphenyl)-4-[2-(4-methoxyphenyl)diazenyl]-
CAS No: 17851-68-2 Catalog No: AG002656 MDL No:
Product Description
Catalog Number:
AG002656
Chemical Name:
2-Naphthalenecarboxamide, 3-hydroxy-N-(4-methoxyphenyl)-4-[2-(4-methoxyphenyl)diazenyl]-
CAS Number:
17851-68-2
Molecular Formula:
C25H21N3O4
Molecular Weight:
427.4519
IUPAC Name:
3-hydroxy-N-(4-methoxyphenyl)-4-[(4-methoxyphenyl)diazenyl]naphthalene-2-carboxamide
InChI:
InChI=1S/C25H21N3O4/c1-31-19-11-7-17(8-12-19)26-25(30)22-15-16-5-3-4-6-21(16)23(24(22)29)28-27-18-9-13-20(32-2)14-10-18/h3-15,29H,1-2H3,(H,26,30)
InChI Key:
OOMQDSVFACGNNL-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)N=Nc1c(O)c(cc2c1cccc2)C(=O)Nc1ccc(cc1)OC
EC Number:
241-803-8
Properties
Complexity:
629
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
427.153g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
427.46g/mol
Monoisotopic Mass:
427.153g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
92.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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