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853748-20-6 | 1-Naphthalenecarboxamide, 4-butyl-N,N-diphenyl-
CAS No: 853748-20-6 Catalog No: AG004KU1 MDL No:
Product Description
Catalog Number:
AG004KU1
Chemical Name:
1-Naphthalenecarboxamide, 4-butyl-N,N-diphenyl-
CAS Number:
853748-20-6
Molecular Formula:
C27H25NO
Molecular Weight:
379.4935
IUPAC Name:
4-butyl-N,N-diphenylnaphthalene-1-carboxamide
InChI:
InChI=1S/C27H25NO/c1-2-3-12-21-19-20-26(25-18-11-10-17-24(21)25)27(29)28(22-13-6-4-7-14-22)23-15-8-5-9-16-23/h4-11,13-20H,2-3,12H2,1H3
InChI Key:
KGDDKVVDGNNNSE-UHFFFAOYSA-N
SMILES:
CCCCc1ccc(c2c1cccc2)C(=O)N(c1ccccc1)c1ccccc1
Properties
Complexity:
487
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
379.194g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
379.503g/mol
Monoisotopic Mass:
379.194g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.6
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