Chemical ID: 6726273

COCc1nc2ccccc2n1Cc3ccc(cc3)Cl
Chemical ID:
6726273
Name [?]:
1-[(4-chlorophenyl)methyl]-2-(methoxymethyl)benzoimidazole
SMILES [?]:
COCc1nc2ccccc2n1Cc3ccc(cc3)Cl
InChi [?]:
InChI=1/C16H15ClN2O/c1-20-11-16-18-14-4-2-3-5-15(14)19(16)10-12-6-8-13(17)9-7-12/h2-9H,10-11H2,1H3
InChi Info:
AuxInfo=1/0/N:1,8,9,7,10,15,19,16,18,13,3,14,17,6,11,4,20,5,12,2/E:(6,7)(8,9)/rA:20nCOCCNCCCCCCNCCCCCCCCl/rB:s1;s2;s3;d4;s5;s6;d7;s8;d9;d6s10;s4s11;s12;s13;s14;d15;s16;d17;d14s18;s17;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H15ClN2O
All Atoms:35
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.09985
Area:462.058
Solvation:-3.4516
Coulombic:-22.2124
Bond Count [?]
All:22
Single:15
Double:7
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:286.756
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.67
LogP (Chemaxon):4.09

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