Chemical ID: 5430025

Cc1ccccc1Cn2c3ccccc3nc2CCNC(=O)C
Chemical ID:
5430025
Name [?]:
N-[2-[1-(o-tolylmethyl)benzoimidazol-2-yl]ethyl]acetamide
SMILES [?]:
Cc1ccccc1Cn2c3ccccc3nc2CCNC(=O)C
InChi [?]:
InChI=1/C19H21N3O/c1-14-7-3-4-8-16(14)13-22-18-10-6-5-9-17(18)21-19(22)11-12-20-15(2)23/h3-10H,11-13H2,1-2H3,(H,20,23)
InChi Info:
AuxInfo=1/1/N:1,23,4,5,13,12,3,6,14,11,18,19,8,2,21,7,15,10,17,20,16,9,22/rA:23nCCCCCCCCNCCCCCCNCCCNCOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;s10;d11;s12;d13;d10s14;s15;s9d16;s17;s18;s19;s20;d21;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H21N3O
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.3807
Area:532.491
Solvation:-2.93161
Coulombic:-33.0108
Bond Count [?]
All:25
Single:17
Double:8
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:307.39
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.33
LogP (Chemaxon):3.42

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