Chemical ID: 7479234

COc1cccc(c1O)C=NNC(=O)c2ccc(cc2)OCc3ccccc3
Chemical ID:
7479234
Name [?]:
4-benzyloxy-N-[(2-hydroxy-3-methoxy-phenyl)methyleneamino]benzamide
SMILES [?]:
COc1cccc(c1O)C=NNC(=O)c2ccc(cc2)OCc3ccccc3
InChi [?]:
InChI=1/C22H20N2O4/c1-27-20-9-5-8-18(21(20)25)14-23-24-22(26)17-10-12-19(13-11-17)28-15-16-6-3-2-4-7-16/h2-14,25H,15H2,1H3,(H,24,26)
InChi Info:
AuxInfo=1/1/N:1,26,25,27,5,24,28,6,4,16,20,17,19,10,22,23,15,7,18,3,8,13,11,12,9,14,2,21/E:(3,4)(6,7)(10,11)(12,13)/rA:28nCOCCCCCCOCNNCOCCCCCCOCCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s7;w10;s11;s12;d13;s13;s15;d16;s17;d18;d15s19;s18;s21;s22;s23;d24;s25;d26;d23s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H20N2O4
All Atoms:48
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:7.59377
Area:621.836
Solvation:-7.95213
Coulombic:-50.6008
Bond Count [?]
All:30
Single:19
Double:11
Rotors:8
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:376.405
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:5.13
LogP (Chemaxon):4.23

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