Chemical ID: 5818888

COc1cc(cc(c1)OC)C(=O)Nc2cccc(c2Cl)Cl
Chemical ID:
5818888
Name [?]:
N-(2,3-dichlorophenyl)-3,5-dimethoxy-benzamide
SMILES [?]:
COc1cc(cc(c1)OC)C(=O)Nc2cccc(c2Cl)Cl
InChi [?]:
InChI=1/C15H13Cl2NO3/c1-20-10-6-9(7-11(8-10)21-2)15(19)18-13-5-3-4-12(16)14(13)17/h3-8H,1-2H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,10,16,17,15,4,6,8,5,3,7,18,14,19,11,21,20,13,12,2,9/E:(1,2)(6,7)(10,11)(20,21)/rA:21nCOCCCCCCOCCONCCCCCCClCl/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;s9;s5;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;s18;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H13Cl2NO3
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:8.5092
Area:506.594
Solvation:-4.15566
Coulombic:-36.5007
Bond Count [?]
All:22
Single:15
Double:7
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:326.174
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.07
LogP (Chemaxon):2.98

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Descriptor Annotations

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