Chemical ID: 6617828

COc1cc(ccc1NC(=O)c2ccc(cc2Cl)Cl)N
Chemical ID:
6617828
Name [?]:
N-(4-amino-2-methoxy-phenyl)-2,4-dichloro-benzamide
SMILES [?]:
COc1cc(ccc1NC(=O)c2ccc(cc2Cl)Cl)N
InChi [?]:
InChI=1/C14H12Cl2N2O2/c1-20-13-7-9(17)3-5-12(13)18-14(19)10-4-2-8(15)6-11(10)16/h2-7H,17H2,1H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,14,6,13,7,16,4,15,5,12,17,8,3,10,19,18,20,9,11,2/rA:20nCOCCCCCCNCOCCCCCCClClN/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;d13;s14;d15;d12s16;s17;s15;s5;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H12Cl2N2O2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:9.1427
Area:488.475
Solvation:-3.06919
Coulombic:-46.0357
Bond Count [?]
All:21
Single:14
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:311.163
H-Bond Donors:3
H-Bond Acceptors:4
XLogP:2.91
LogP (Chemaxon):3.1

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