Chemical ID: 5392393

c1ccc(c(c1)c2[nH]c3ccccc3n2)NC(=O)Cc4ccc(cc4)Cl
Chemical ID:
5392393
Name [?]:
N-[2-(1H-benzoimidazol-2-yl)phenyl]-2-(4-chlorophenyl)-acetamide
SMILES [?]:
c1ccc(c(c1)c2[nH]c3ccccc3n2)NC(=O)Cc4ccc(cc4)Cl
InChi [?]:
InChI=1/C21H16ClN3O/c22-15-11-9-14(10-12-15)13-20(26)23-17-6-2-1-5-16(17)21-24-18-7-3-4-8-19(18)25-21/h1-12H,13H2,(H,23,26)(H,24,25)
InChi Info:
AuxInfo=1/1/N:1,2,11,12,6,3,10,13,21,25,22,24,19,20,23,5,4,9,14,17,7,26,16,8,15,18/E:(3,4)(7,8)(9,10)(11,12)(18,19)(24,25)/rA:26nCCCCCCCNCCCCCCNNCOCCCCCCCCl/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;s9;d10;s11;d12;d9s13;d7s14;s4;s16;d17;s17;s19;s20;d21;s22;d23;d20s24;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H16ClN3O
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.5983
Area:574.56
Solvation:-2.76573
Coulombic:-40.1406
Bond Count [?]
All:29
Single:18
Double:11
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:361.824
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.67
LogP (Chemaxon):5.53

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