Chemical ID: 6964986

c1ccc2c(c1)ccc(c2Br)OCC(=O)NN=Cc3cccc(c3)O
Chemical ID:
6964986
Name [?]:
2-[(1-bromo-2-naphthyl)oxy]-N-[(3-hydroxyphenyl)methyleneamino]acetamide
SMILES [?]:
c1ccc2c(c1)ccc(c2Br)OCC(=O)NN=Cc3cccc(c3)O
InChi [?]:
InChI=1/C19H15BrN2O3/c20-19-16-7-2-1-5-14(16)8-9-17(19)25-12-18(24)22-21-11-13-4-3-6-15(23)10-13/h1-11,23H,12H2,(H,22,24)
InChi Info:
AuxInfo=1/1/N:1,2,21,20,6,22,3,7,8,24,18,13,19,5,23,4,9,14,10,11,17,16,25,15,12/rA:25nCCCCCCCCCCBrOCCONNCCCCCCCO/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s10;s9;s12;s13;d14;s14;s16;w17;s18;s19;d20;s21;d22;d19s23;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H15BrN2O3
All Atoms:40
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:7.75289
Area:578.407
Solvation:-6.70728
Coulombic:-42.5549
Bond Count [?]
All:27
Single:17
Double:10
Rotors:6
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:399.238
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:5.33
LogP (Chemaxon):4.53

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