Chemical ID: 4279413

c1cc(ccc1C(=O)N)NC(=O)COc2ccc(cc2)Br
Chemical ID:
4279413
Name [?]:
4-[2-(4-bromophenoxy)acetyl]aminobenzamide
SMILES [?]:
c1cc(ccc1C(=O)N)NC(=O)COc2ccc(cc2)Br
InChi [?]:
InChI=1/C15H13BrN2O3/c16-11-3-7-13(8-4-11)21-9-14(19)18-12-5-1-10(2-6-12)15(17)20/h1-8H,9H2,(H2,17,20)(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,5,17,19,2,4,16,20,13,6,18,3,15,11,7,21,9,10,12,8,14/E:(1,2)(3,4)(5,6)(7,8)/rA:21nCCCCCCCONNCOCOCCCCCCBr/rB:s1;d2;s3;d4;d1s5;s6;d7;s7;s3;s10;d11;s11;s13;s14;s15;d16;s17;d18;d15s19;s18;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H13BrN2O3
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:7.76542
Area:507.661
Solvation:-4.9261
Coulombic:-53.8844
Bond Count [?]
All:22
Single:14
Double:8
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:349.179
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:2.36
LogP (Chemaxon):2.32

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