Chemical ID: 6414378

Cc1cccc(c1N=Cc2cc(cc(c2O)OC)Br)O
Chemical ID:
6414378
Name [?]:
4-bromo-2-[(2-hydroxy-6-methyl-phenyl)iminomethyl]-6-methoxy-phenol
SMILES [?]:
Cc1cccc(c1N=Cc2cc(cc(c2O)OC)Br)O
InChi [?]:
InChI=1/C15H14BrNO3/c1-9-4-3-5-12(18)14(9)17-8-10-6-11(16)7-13(20-2)15(10)19/h3-8,18-19H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,18,4,3,5,11,13,9,2,10,12,6,14,7,15,19,8,20,16,17/rA:20nCCCCCCCNCCCCCCCOOCBrO/rB:s1;s2;d3;s4;d5;d2s6;s7;w8;s9;s10;d11;s12;d13;d10s14;s15;s14;s17;s12;s6;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14BrNO3
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:6.50397
Area:439.04
Solvation:-4.47203
Coulombic:-45.2691
Bond Count [?]
All:21
Single:14
Double:7
Rotors:3
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:336.181
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.08
LogP (Chemaxon):4.69

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