Chemical ID: 6239594

CCCn1c2ccccc2nc1CCNC(=O)c3cccc(c3)C
Chemical ID:
6239594
Name [?]:
3-methyl-N-[2-(1-propylbenzoimidazol-2-yl)ethyl]benzamide
SMILES [?]:
CCCn1c2ccccc2nc1CCNC(=O)c3cccc(c3)C
InChi [?]:
InChI=1/C20H23N3O/c1-3-13-23-18-10-5-4-9-17(18)22-19(23)11-12-21-20(24)16-8-6-7-15(2)14-16/h4-10,14H,3,11-13H2,1-2H3,(H,21,24)
InChi Info:
AuxInfo=1/1/N:1,24,2,8,7,20,21,19,9,6,13,14,3,23,22,18,10,5,12,16,15,11,4,17/rA:24nCCCNCCCCCCNCCCNCOCCCCCCC/rB:s1;s2;s3;s4;s5;d6;s7;d8;d5s9;s10;s4d11;s12;s13;s14;s15;d16;s16;s18;d19;s20;d21;d18s22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H23N3O
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:11.4766
Area:561.238
Solvation:-2.55437
Coulombic:-35.421
Bond Count [?]
All:26
Single:18
Double:8
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:321.416
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.12
LogP (Chemaxon):4.19

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