Chemical ID: 4806682

Cc1ccc(cc1)c2nc(on2)c3ccccc3C(=O)N4CCC(CC4)C
Chemical ID:
4806682
Name [?]:
(4-methyl-1-piperidyl)-[2-[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]phenyl]-methanone
SMILES [?]:
Cc1ccc(cc1)c2nc(on2)c3ccccc3C(=O)N4CCC(CC4)C
InChi [?]:
InChI=1/C22H23N3O2/c1-15-7-9-17(10-8-15)20-23-21(27-24-20)18-5-3-4-6-19(18)22(26)25-13-11-16(2)12-14-25/h3-10,16H,11-14H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,27,15,16,14,17,3,7,4,6,23,25,22,26,2,24,5,13,18,8,10,19,9,12,21,20,11/E:(7,8)(9,10)(11,12)(13,14)/rA:27nCCCCCCCCNCONCCCCCCCONCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;d9;s10;d8s11;s10;s13;d14;s15;d16;d13s17;s18;d19;s19;s21;s22;s23;s24;s21s25;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H23N3O2
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:11.5709
Area:572.026
Solvation:-2.72978
Coulombic:-31.8381
Bond Count [?]
All:30
Single:21
Double:9
Rotors:4
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:361.437
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:5.46
LogP (Chemaxon):4.74

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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