Chemical ID: 3966083

c1ccc(cc1)C(c2ccccc2)(c3ccccc3Cl)n4ccnc4
Chemical ID:
3966083
Name [?]:
1-[(2-chlorophenyl)-diphenyl-methyl]imidazole
SMILES [?]:
c1ccc(cc1)C(c2ccccc2)(c3ccccc3Cl)n4ccnc4
InChi [?]:
InChI=1/C22H17ClN2/c23-21-14-8-7-13-20(21)22(25-16-15-24-17-25,18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-17H
InChi Info:
AuxInfo=1/0/N:1,11,2,6,10,12,16,17,3,5,9,13,15,18,23,22,25,4,8,14,19,7,20,24,21/E:(1,2)(3,4,5,6)(9,10,11,12)(18,19)/rA:25nCCCCCCCCCCCCCCCCCCCClNCCNC/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s10;d11;d8s12;s7;s14;d15;s16;d17;d14s18;s19;s7;s21;d22;s23;s21d24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H17ClN2
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:10.4499
Area:495.471
Solvation:-1.9369
Coulombic:-17.2969
Bond Count [?]
All:28
Single:17
Double:11
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:344.837
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:6.14
LogP (Chemaxon):5.94

Name Annotations

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Descriptor Annotations

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