Chemical ID: 6157953

c1cc(ccc1C#N)NC(=O)COc2ccc(cc2Cl)Cl
Chemical ID:
6157953
Name [?]:
N-(4-cyanophenyl)-2-(2,4-dichlorophenoxy)-acetamide
SMILES [?]:
c1cc(ccc1C#N)NC(=O)COc2ccc(cc2Cl)Cl
InChi [?]:
InChI=1/C15H10Cl2N2O2/c16-11-3-6-14(13(17)7-11)21-9-15(20)19-12-4-1-10(8-18)2-5-12/h1-7H,9H2,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,5,16,2,4,15,18,7,12,6,17,3,19,14,10,21,20,8,9,11,13/E:(1,2)(4,5)/rA:21nCCCCCCCNNCOCOCCCCCCClCl/rB:s1;d2;s3;d4;d1s5;s6;t7;s3;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;s19;s17;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H10Cl2N2O2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:8.58689
Area:531.771
Solvation:-4.7074
Coulombic:-31.7612
Bond Count [?]
All:22
Single:14
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:321.158
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.64
LogP (Chemaxon):3.73

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