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102187-53-1 | 2-Naphthalenecarboxamide, 4-[[4-(diethylamino)-2-methylphenyl]imino]-1,4-dihydro-N-methyl-1-oxo-
CAS No: 102187-53-1 Catalog No: AG0006UP MDL No:MFCD12911610
Product Description
Catalog Number:
AG0006UP
Chemical Name:
2-Naphthalenecarboxamide, 4-[[4-(diethylamino)-2-methylphenyl]imino]-1,4-dihydro-N-methyl-1-oxo-
CAS Number:
102187-53-1
Molecular Formula:
C23H25N3O2
Molecular Weight:
375.4635
MDL Number:
MFCD12911610
IUPAC Name:
4-[4-(diethylamino)-2-methylphenyl]imino-N-methyl-1-oxonaphthalene-2-carboxamide
InChI:
InChI=1S/C23H25N3O2/c1-5-26(6-2)16-11-12-20(15(3)13-16)25-21-14-19(23(28)24-4)22(27)18-10-8-7-9-17(18)21/h7-14H,5-6H2,1-4H3,(H,24,28)
InChI Key:
ICEZCGKMKDYPQG-UHFFFAOYSA-N
SMILES:
CCN(c1ccc(c(c1)C)N=C1C=C(C(=O)NC)C(=O)c2c1cccc2)CC
Properties
Complexity:
650
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
375.195g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
375.472g/mol
Monoisotopic Mass:
375.195g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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