Chemical ID: 7305459

COc1ccc(cc1NC(=O)CNc2ccc(cc2)Br)Cl
Chemical ID:
7305459
Name [?]:
2-(4-bromophenyl)amino-N-(5-chloro-2-methoxy-phenyl)-acetamide
SMILES [?]:
COc1ccc(cc1NC(=O)CNc2ccc(cc2)Br)Cl
InChi [?]:
InChI=1/C15H14BrClN2O2/c1-21-14-7-4-11(17)8-13(14)19-15(20)9-18-12-5-2-10(16)3-6-12/h2-8,18H,9H2,1H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,16,18,5,15,19,4,7,12,17,6,14,8,3,10,20,21,13,9,11,2/E:(2,3)(5,6)/rA:21nCOCCCCCCNCOCNCCCCCCBrCl/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;s17;s6;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14BrClN2O2
All Atoms:35
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:9.8168
Area:526.449
Solvation:-3.34441
Coulombic:-41.1238
Bond Count [?]
All:22
Single:15
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:369.641
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.74
LogP (Chemaxon):3.76

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