Chemical ID: 7020439

Cc1cccc(c1)C(=O)NC(c2ccccc2F)NC(=O)c3cccc(c3)C
Chemical ID:
7020439
Name [?]:
N-[(2-fluorophenyl)-(3-methylbenzoyl)amino-methyl]-3-methyl-benzamide
SMILES [?]:
Cc1cccc(c1)C(=O)NC(c2ccccc2F)NC(=O)c3cccc(c3)C
InChi [?]:
InChI=1/C23H21FN2O2/c1-15-7-5-9-17(13-15)22(27)25-21(19-11-3-4-12-20(19)24)26-23(28)18-10-6-8-16(2)14-18/h3-14,21H,1-2H3,(H,25,27)(H,26,28)
InChi Info:
AuxInfo=1/1/N:1,28,14,15,4,24,3,25,5,23,13,16,7,27,2,26,6,22,12,17,11,8,20,18,10,19,9,21/E:(1,2)(5,6)(7,8)(9,10)(13,14)(15,16)(17,18)(22,23)(25,26)(27,28)/gE:(1,2)/rA:28cCCCCCCCCONCCCCCCCFNCOCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s8;s10;s11;s12;d13;s14;d15;d12s16;s17;s11;s19;d20;s20;s22;d23;s24;d25;d22s26;s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H21FN2O2
All Atoms:49
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:10.9242
Area:600.053
Solvation:-4.07713
Coulombic:-50.1806
Bond Count [?]
All:30
Single:19
Double:11
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:376.424
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:5.63
LogP (Chemaxon):4.9

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