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84809-08-5 | 11H-Benzo[a]carbazole-3-carboxamide, N-(4-ethylphenyl)-2-hydroxy-
CAS No: 84809-08-5 Catalog No: AG004NFJ MDL No:
Product Description
Catalog Number:
AG004NFJ
Chemical Name:
11H-Benzo[a]carbazole-3-carboxamide, N-(4-ethylphenyl)-2-hydroxy-
CAS Number:
84809-08-5
Molecular Formula:
C25H20N2O2
Molecular Weight:
380.4385
IUPAC Name:
N-(4-ethylphenyl)-2-hydroxy-11H-benzo[a]carbazole-3-carboxamide
InChI:
InChI=1S/C25H20N2O2/c1-2-15-7-10-17(11-8-15)26-25(29)21-13-16-9-12-19-18-5-3-4-6-22(18)27-24(19)20(16)14-23(21)28/h3-14,27-28H,2H2,1H3,(H,26,29)
InChI Key:
WBEFXLQXSWTVMX-UHFFFAOYSA-N
SMILES:
CCc1ccc(cc1)NC(=O)c1cc2ccc3c(c2cc1O)[nH]c1c3cccc1
Properties
Complexity:
587
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
380.152g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
380.447g/mol
Monoisotopic Mass:
380.152g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
65.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5
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