N-(2-OXO-2-(PHENYLAMINO)ETHYL)BENZAMIDE

/static/temp/default.svg Search structure
Molecule Category Free-form
Source Gaulton A, Kale N, van Westen GJ, Bellis LJ, Bento AP, Davies M, Hersey A, Papadatos G, Forster M, Wege P, Overington JP. A large-scale crop protection bioassay data set. Sci Data. 2015 Jul 7;2:150032. Read more ...

Structure

InChI Key ZSQKXQFAKRHLTP-UHFFFAOYSA-N
Smiles O=C(CNC(=O)c1ccccc1)Nc2ccccc2
InChI
InChI=1S/C15H14N2O2/c18-14(17-13-9-5-2-6-10-13)11-16-15(19)12-7-3-1-4-8-12/h1-10H,11H2,(H,16,19)(H,17,18)

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H14N2O2
Molecular Weight 254.28
AlogP 1.67
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 4.0
Polar Surface Area 58.2
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 19.0

Cross References

Resources Reference
ChEMBL CHEMBL2299181
PubChem 269632
SureChEMBL SCHEMBL3050069
ZINC ZINC01075322
CONTENTS