Chemical ID: 6884140

c1ccc(c(c1)NC(=O)c2ccc(cc2)OCC(=O)Nc3cccc(c3)Cl)Cl
Chemical ID:
6884140
Name [?]:
N-(2-chlorophenyl)-4-[(3-chlorophenyl)carbamoylmethoxy]benzamide
SMILES [?]:
c1ccc(c(c1)NC(=O)c2ccc(cc2)OCC(=O)Nc3cccc(c3)Cl)Cl
InChi [?]:
InChI=1/C21H16Cl2N2O3/c22-15-4-3-5-16(12-15)24-20(26)13-28-17-10-8-14(9-11-17)21(27)25-19-7-2-1-6-18(19)23/h1-12H,13H2,(H,24,26)(H,25,27)
InChi Info:
AuxInfo=1/1/N:2,1,23,24,22,3,6,11,15,12,14,26,17,10,25,21,13,4,5,18,8,27,28,20,7,19,9,16/E:(8,9)(10,11)/rA:28nCCCCCCNCOCCCCCCOCCONCCCCCCClCl/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s8;s10;d11;s12;d13;d10s14;s13;s16;s17;d18;s18;s20;s21;d22;s23;d24;d21s25;s25;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H16Cl2N2O3
All Atoms:44
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:11.152
Area:642.696
Solvation:-4.91539
Coulombic:-51.6176
Bond Count [?]
All:30
Single:19
Double:11
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:415.269
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:4.89
LogP (Chemaxon):4.32

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