Chemical ID: 5049619

Cc1ccc(cc1)Nc2c-3c4c(cccc4n(c2=O)C)C(=O)c5c3cccc5
Chemical ID:
5049619
Name [?]:
None
SMILES [?]:
Cc1ccc(cc1)Nc2c-3c4c(cccc4n(c2=O)C)C(=O)c5c3cccc5
InChi [?]:
InChI=1/C24H18N2O2/c1-14-10-12-15(13-11-14)25-22-21-16-6-3-4-7-17(16)23(27)18-8-5-9-19(20(18)21)26(2)24(22)28/h3-13,25H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,20,26,27,14,25,28,13,15,3,7,4,6,2,5,24,23,12,16,11,10,9,21,18,8,17,22,19/E:(10,11)(12,13)/rA:28nCCCCCCCNCCCCCCCCNCOCCOCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;d9;s10;s11;d12;s13;d14;d11s15;s16;s9s17;d18;s17;s12;d21;s21;s10s23;d24;s25;d26;d23s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H18N2O2
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:10.5678
Area:535.693
Solvation:-2.82455
Coulombic:-39.7719
Bond Count [?]
All:32
Single:20
Double:12
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:366.412
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.18
LogP (Chemaxon):4.76

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