Chemical ID: 6283096

Cc1ccc(cc1C)C(=O)Nc2nnc(o2)c3ccccc3
Chemical ID:
6283096
Name [?]:
3,4-dimethyl-N-(5-phenyl-1,3,4-oxadiazol-2-yl)-benzamide
SMILES [?]:
Cc1ccc(cc1C)C(=O)Nc2nnc(o2)c3ccccc3
InChi [?]:
InChI=1/C17H15N3O2/c1-11-8-9-14(10-12(11)2)15(21)18-17-20-19-16(22-17)13-6-4-3-5-7-13/h3-10H,1-2H3,(H,18,20,21)
InChi Info:
AuxInfo=1/1/N:1,8,20,19,21,18,22,3,4,6,2,7,17,5,9,15,12,11,14,13,10,16/E:(4,5)(6,7)/rA:22nCCCCCCCCCONCNNCOCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;d9;s9;s11;d12;s13;d14;s12s15;s15;s17;d18;s19;d20;d17s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H15N3O2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:10.309
Area:504.223
Solvation:-2.29659
Coulombic:-38.6186
Bond Count [?]
All:24
Single:15
Double:9
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:293.32
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.23
LogP (Chemaxon):3.8

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