Chemical ID: 5790691

c1ccc(cc1)COc2ccccc2C=NNC(=O)COc3ccc(cc3)Cl
Chemical ID:
5790691
Name [?]:
N-[(2-benzyloxyphenyl)methyleneamino]-2-(4-chlorophenoxy)-acetamide
SMILES [?]:
c1ccc(cc1)COc2ccccc2C=NNC(=O)COc3ccc(cc3)Cl
InChi [?]:
InChI=1/C22H19ClN2O3/c23-19-10-12-20(13-11-19)27-16-22(26)25-24-14-18-8-4-5-9-21(18)28-15-17-6-2-1-3-7-17/h1-14H,15-16H2,(H,25,26)
InChi Info:
AuxInfo=1/1/N:1,2,6,12,11,3,5,13,10,24,26,23,27,15,7,20,4,14,25,22,9,18,28,16,17,19,21,8/E:(2,3)(6,7)(10,11)(12,13)/rA:28nCCCCCCCOCCCCCCCNNCOCOCCCCCCCl/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;d10;s11;d12;d9s13;s14;w15;s16;s17;d18;s18;s20;s21;s22;d23;s24;d25;d22s26;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H19ClN2O3
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:9.56976
Area:650.448
Solvation:-6.69145
Coulombic:-35.9588
Bond Count [?]
All:30
Single:19
Double:11
Rotors:9
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:394.851
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:5.92
LogP (Chemaxon):5.06

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