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Chemical ID: 7514892
Chemical ID:
7514892
Name [?]:
1-benzyl-4-phenyl-imidazole
SMILES [?]:
c1ccc(cc1)Cn2cc(nc2)c3ccccc3
InChi [?]:
InChI=1/C16H14N2/c1-3-7-14(8-4-1)11-18-12-16(17-13-18)15-9-5-2-6-10-15/h1-10,12-13H,11H2
InChi Info:
AuxInfo=1/0/N:1,16,2,6,15,17,3,5,14,18,7,9,12,4,13,10,11,8/E:(3,4)(5,6)(7,8)(9,10)/rA:18nCCCCCCCNCCNCCCCCCC/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s10;s8d11;s10;s13;d14;s15;d16;d13s17;/rC:;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H14N2 |
All Atoms: | 32 |
Heavy Atoms: | 18 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 8.89725 |
Area: | 434.565 |
Solvation: | -1.96688 |
Coulombic: | -14.1695 |
Bond Count [?]
All: | 20 |
Single: | 12 |
Double: | 8 |
Rotors: | 3 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 4.24 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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