Chemical ID: 5755265

c1ccc(cc1)COc2ccc(cc2)C=NNC(=O)COc3ccc(cc3Cl)Cl
Chemical ID:
5755265
Name [?]:
N-[(4-benzyloxyphenyl)methyleneamino]-2-(2,4-dichlorophenoxy)-acetamide
SMILES [?]:
c1ccc(cc1)COc2ccc(cc2)C=NNC(=O)COc3ccc(cc3Cl)Cl
InChi [?]:
InChI=1/C22H18Cl2N2O3/c23-18-8-11-21(20(24)12-18)29-15-22(27)26-25-13-16-6-9-19(10-7-16)28-14-17-4-2-1-3-5-17/h1-13H,14-15H2,(H,26,27)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,11,13,24,10,14,23,26,15,7,20,12,4,25,9,27,22,18,29,28,16,17,19,8,21/E:(2,3)(4,5)(6,7)(9,10)/rA:29nCCCCCCCOCCCCCCCNNCOCOCCCCCCClCl/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;d10;s11;d12;d9s13;s12;w15;s16;s17;d18;s18;s20;s21;s22;d23;s24;d25;d22s26;s27;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H18Cl2N2O3
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:9.52933
Area:681.209
Solvation:-7.5009
Coulombic:-34.8813
Bond Count [?]
All:31
Single:20
Double:11
Rotors:9
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:429.295
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:6.54
LogP (Chemaxon):5.58

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