Chemical ID: 6433907

Cc1ccc(c(c1)OCC(=O)NN=Cc2ccc(cc2)OC)C(C)C
Chemical ID:
6433907
Name [?]:
2-(2-isopropyl-5-methyl-phenoxy)-N-[(4-methoxyphenyl)methyleneamino]acetamide
SMILES [?]:
Cc1ccc(c(c1)OCC(=O)NN=Cc2ccc(cc2)OC)C(C)C
InChi [?]:
InChI=1/C20H24N2O3/c1-14(2)18-10-5-15(3)11-19(18)25-13-20(23)22-21-12-16-6-8-17(24-4)9-7-16/h5-12,14H,13H2,1-4H3,(H,22,23)
InChi Info:
AuxInfo=1/1/N:24,25,1,22,3,16,20,17,19,4,7,14,9,23,2,15,18,5,6,10,13,12,11,21,8/E:(1,2)(6,7)(8,9)/rA:25nCCCCCCCOCCONNCCCCCCCOCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;d10;s10;s12;w13;s14;s15;d16;s17;d18;d15s19;s18;s21;s5;s23;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H24N2O3
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:8.02608
Area:588.173
Solvation:-6.67825
Coulombic:-33.5539
Bond Count [?]
All:26
Single:18
Double:8
Rotors:8
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:340.416
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:5.22
LogP (Chemaxon):4.42

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