Chemical ID: 4513401

Cc1ccc(cc1)NC(=O)c2cc(cc(c2O)Br)Cl
Chemical ID:
4513401
Name [?]:
3-bromo-5-chloro-2-hydroxy-N-(p-tolyl)benzamide
SMILES [?]:
Cc1ccc(cc1)NC(=O)c2cc(cc(c2O)Br)Cl
InChi [?]:
InChI=1/C14H11BrClNO2/c1-8-2-4-10(5-3-8)17-14(19)11-6-9(16)7-12(15)13(11)18/h2-7,18H,1H3,(H,17,19)
InChi Info:
AuxInfo=1/1/N:1,3,7,4,6,12,14,2,13,5,11,15,16,9,18,19,8,17,10/E:(2,3)(4,5)/rA:19nCCCCCCCNCOCCCCCCOBrCl/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;d9;s9;s11;d12;s13;d14;d11s15;s16;s15;s13;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H11BrClNO2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.60219
Area:471.778
Solvation:-3.19225
Coulombic:-37.2462
Bond Count [?]
All:20
Single:13
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:340.599
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:4.87
LogP (Chemaxon):4.6

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