Chemical ID: 7012449

CN(C)c1ccc(cc1)C2C(=C(C(=O)N2CCc3ccccc3)O)C(=O)c4ccccc4
Chemical ID:
7012449
Name [?]:
4-benzoyl-5-(4-dimethylaminophenyl)-3-hydroxy-1-phenethyl-5H-pyrrol-2-one
SMILES [?]:
CN(C)c1ccc(cc1)C2C(=C(C(=O)N2CCc3ccccc3)O)C(=O)c4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H26N2O3
All Atoms:58
Heavy Atoms:32
Chiral Atoms:1
ZAP Information [?]
Total:12.5709
Area:680.541
Solvation:-4.44261
Coulombic:-52.2148
Bond Count [?]
All:35
Single:23
Double:12
Rotors:7
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:426.507
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:5.28
LogP (Chemaxon):4.16

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue