Chemical ID: 4660834

Cc1nc2ccccc2n1Cc3ccccc3OC
Chemical ID:
4660834
Name [?]:
1-[(2-methoxyphenyl)methyl]-2-methyl-benzoimidazole
SMILES [?]:
Cc1nc2ccccc2n1Cc3ccccc3OC
InChi [?]:
InChI=1/C16H16N2O/c1-12-17-14-8-4-5-9-15(14)18(12)11-13-7-3-6-10-16(13)19-2/h3-10H,11H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,19,14,6,7,15,13,5,8,16,11,2,12,4,9,17,3,10,18/rA:19nCCNCCCCCCNCCCCCCCOC/rB:s1;d2;s3;s4;d5;s6;d7;d4s8;s2s9;s10;s11;s12;d13;s14;d15;d12s16;s17;s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H16N2O
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:7.82963
Area:417.905
Solvation:-2.618
Coulombic:-20.3213
Bond Count [?]
All:21
Single:14
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:252.311
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.48
LogP (Chemaxon):3.6

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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