Chemical ID: 5833226

CN(C)c1ccc(cc1)CNc2ccc3c(c2)ncn3c4ccccc4
Chemical ID:
5833226
Name [?]:
N-[(4-dimethylaminophenyl)methyl]-1-phenyl-benzoimidazol-5-amine
SMILES [?]:
CN(C)c1ccc(cc1)CNc2ccc3c(c2)ncn3c4ccccc4
InChi [?]:
InChI=1/C22H22N4/c1-25(2)19-11-8-17(9-12-19)15-23-18-10-13-22-21(14-18)24-16-26(22)20-6-4-3-5-7-20/h3-14,16,23H,15H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,24,23,25,22,26,6,8,13,5,9,14,17,10,19,7,12,4,21,16,15,11,18,2,20/E:(1,2)(4,5)(6,7)(8,9)(11,12)/rA:26nCNCCCCCCCCNCCCCCCNCNCCCCCC/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s7;s10;s11;s12;d13;s14;d15;d12s16;s16;d18;s15s19;s20;s21;d22;s23;d24;d21s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H22N4
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.8279
Area:580.466
Solvation:-2.68371
Coulombic:-31.042
Bond Count [?]
All:29
Single:19
Double:10
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:342.437
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.75
LogP (Chemaxon):4.82

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Descriptor Annotations

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