Chemical ID: 4236427

Cc1cccc2c1n(c(cc2=O)C)CC(=O)Nc3cccc(c3)OC
Chemical ID:
4236427
Name [?]:
2-(2,8-dimethyl-4-oxo-1-quinolyl)-N-(3-methoxyphenyl)-acetamide
SMILES [?]:
Cc1cccc2c1n(c(cc2=O)C)CC(=O)Nc3cccc(c3)OC
InChi [?]:
InChI=1/C20H20N2O3/c1-13-6-4-9-17-18(23)10-14(2)22(20(13)17)12-19(24)21-15-7-5-8-16(11-15)25-3/h4-11H,12H2,1-3H3,(H,21,24)
InChi Info:
AuxInfo=1/1/N:1,13,25,4,20,3,19,21,5,10,23,14,2,9,18,22,6,11,15,7,17,8,12,16,24/rA:25nCCCCCCCNCCCOCCCONCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s6s10;d11;s9;s8;s14;d15;s15;s17;s18;d19;s20;d21;d18s22;s22;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H20N2O3
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:8.21221
Area:535.29
Solvation:-5.17003
Coulombic:-41.5861
Bond Count [?]
All:27
Single:18
Double:9
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:336.384
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.21
LogP (Chemaxon):3.55

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