Chemical ID: 5502261

Cc1c(cc(cc1OC)C(=O)Nc2cccc3c2cccc3)OC
Chemical ID:
5502261
Name [?]:
3,5-dimethoxy-4-methyl-N-(1-naphthyl)benzamide
SMILES [?]:
Cc1c(cc(cc1OC)C(=O)Nc2cccc3c2cccc3)OC
InChi [?]:
InChI=1/C20H19NO3/c1-13-18(23-2)11-15(12-19(13)24-3)20(22)21-17-10-6-8-14-7-4-5-9-16(14)17/h4-12H,1-3H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,9,24,21,20,15,22,16,19,14,6,4,2,17,5,18,13,7,3,10,12,11,8,23/E:(2,3)(11,12)(18,19)(23,24)/rA:24nCCCCCCCOCCONCCCCCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s5;d10;s10;s12;s13;d14;s15;d16;d13s17;s18;d19;s20;s17d21;s3;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H19NO3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:8.58471
Area:521.405
Solvation:-4.45042
Coulombic:-36.8017
Bond Count [?]
All:26
Single:17
Double:9
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:321.37
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.31
LogP (Chemaxon):4.07

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