Chemical ID: 4191129

COc1ccc(cc1C(=O)Nc2ccc(cc2Cl)Cl)Cl
Chemical ID:
4191129
Name [?]:
5-chloro-N-(2,4-dichlorophenyl)-2-methoxy-benzamide
SMILES [?]:
COc1ccc(cc1C(=O)Nc2ccc(cc2Cl)Cl)Cl
InChi [?]:
InChI=1/C14H10Cl3NO2/c1-20-13-5-3-8(15)6-10(13)14(19)18-12-4-2-9(16)7-11(12)17/h2-7H,1H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,14,5,13,4,7,16,6,15,8,17,12,3,9,20,19,18,11,10,2/rA:20nCOCCCCCCCONCCCCCCClClCl/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;d9;s9;s11;s12;d13;s14;d15;d12s16;s17;s15;s6;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H10Cl3NO2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:9.18161
Area:505.589
Solvation:-3.4581
Coulombic:-29.3891
Bond Count [?]
All:21
Single:14
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:330.593
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.77
LogP (Chemaxon):3.75

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