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Chemical ID: 6466764
Chemical ID:
6466764
Name [?]:
3,5-dichloro-4-ethoxy-N-(2-hydroxyphenyl)-benzamide
SMILES [?]:
CCOc1c(cc(cc1Cl)C(=O)Nc2ccccc2O)Cl
InChi [?]:
InChI=1/C15H13Cl2NO3/c1-2-21-14-10(16)7-9(8-11(14)17)15(20)18-12-5-3-4-6-13(12)19/h3-8,19H,2H2,1H3,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,2,16,17,15,18,6,8,7,5,9,14,19,4,11,21,10,13,20,12,3/E:(7,8)(10,11)(16,17)/rA:21nCCOCCCCCCClCONCCCCCCOCl/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s7;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;s5;/rC:;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H13Cl2NO3 |
All Atoms: | 21 |
Heavy Atoms: | 21 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.33043 |
Area: | 511.503 |
Solvation: | -3.45716 |
Coulombic: | -46.7095 |
Bond Count [?]
All: | 22 |
Single: | 15 |
Double: | 7 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 326.174 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 4 |
XLogP: | 4.6 |
LogP (Chemaxon): | 3.94 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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