Chemical ID: 5525477

CCOc1ccccc1C=NNC(=O)c2cc(ccc2O)Br
Chemical ID:
5525477
Name [?]:
5-bromo-N-[(2-ethoxyphenyl)methyleneamino]-2-hydroxy-benzamide
SMILES [?]:
CCOc1ccccc1C=NNC(=O)c2cc(ccc2O)Br
InChi [?]:
InChI=1/C16H15BrN2O3/c1-2-22-15-6-4-3-5-11(15)10-18-19-16(21)13-9-12(17)7-8-14(13)20/h3-10,20H,2H2,1H3,(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,2,7,6,8,5,18,19,16,10,9,17,15,20,4,13,22,11,12,21,14,3/rA:22nCCOCCCCCCCNNCOCCCCCCOBr/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;w10;s11;s12;d13;s13;s15;d16;s17;d18;d15s19;s20;s17;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H15BrN2O3
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:7.85934
Area:516.105
Solvation:-5.04329
Coulombic:-42.8442
Bond Count [?]
All:23
Single:15
Double:8
Rotors:6
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:363.206
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:5.15
LogP (Chemaxon):4.49

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