Chemical ID: 4708629

c1ccc(cc1)COc2ccc(c(c2)Cl)C(=O)NCc3ccc(cc3)Cl
Chemical ID:
4708629
Name [?]:
4-benzyloxy-2-chloro-N-[(4-chlorophenyl)methyl]benzamide
SMILES [?]:
c1ccc(cc1)COc2ccc(c(c2)Cl)C(=O)NCc3ccc(cc3)Cl
InChi [?]:
InChI=1/C21H17Cl2NO2/c22-17-8-6-15(7-9-17)13-24-21(25)19-11-10-18(12-20(19)23)26-14-16-4-2-1-3-5-16/h1-12H,13-14H2,(H,24,25)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,21,25,22,24,10,11,14,19,7,20,4,23,9,12,13,16,26,15,18,17,8/E:(2,3)(4,5)(6,7)(8,9)/rA:26nCCCCCCCOCCCCCCClCONCCCCCCCCl/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;d10;s11;d12;d9s13;s13;s12;d16;s16;s18;s19;s20;d21;s22;d23;d20s24;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H17Cl2NO2
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.7934
Area:619.531
Solvation:-3.69487
Coulombic:-32.7004
Bond Count [?]
All:28
Single:18
Double:10
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:386.271
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:6.01
LogP (Chemaxon):5.28

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