Chemical ID: 6645716

CCCCc1ccc(cc1)OCC(=O)NN=Cc2ccc(c(c2)OC)O
Chemical ID:
6645716
Name [?]:
2-(4-butylphenoxy)-N-[(4-hydroxy-3-methoxy-phenyl)methyleneamino]acetamide
SMILES [?]:
CCCCc1ccc(cc1)OCC(=O)NN=Cc2ccc(c(c2)OC)O
InChi [?]:
InChI=1/C20H24N2O4/c1-3-4-5-15-6-9-17(10-7-15)26-14-20(24)22-21-13-16-8-11-18(23)19(12-16)25-2/h6-13,23H,3-5,14H2,1-2H3,(H,22,24)
InChi Info:
AuxInfo=1/1/N:1,25,2,3,4,6,10,19,7,9,20,23,17,12,5,18,8,21,22,13,16,15,26,14,24,11/E:(6,7)(9,10)/rA:26nCCCCCCCCCCOCCONNCCCCCCCOCO/rB:s1;s2;s3;s4;s5;d6;s7;d8;d5s9;s8;s11;s12;d13;s13;s15;w16;s17;s18;d19;s20;d21;d18s22;s22;s24;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H24N2O4
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:7.53219
Area:618.63
Solvation:-7.93355
Coulombic:-49.1719
Bond Count [?]
All:27
Single:19
Double:8
Rotors:10
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:356.416
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:5.22
LogP (Chemaxon):4.14

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