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Chemical ID: 5761665
Chemical ID:
5761665
Name [?]:
2,5-dichloro-N-(2,3-dimethylphenyl)-benzamide
SMILES [?]:
Cc1cccc(c1C)NC(=O)c2cc(ccc2Cl)Cl
InChi [?]:
InChI=1/C15H13Cl2NO/c1-9-4-3-5-14(10(9)2)18-15(19)12-8-11(16)6-7-13(12)17/h3-8H,1-2H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,8,4,3,5,15,16,13,2,7,14,12,17,6,10,19,18,9,11/rA:19nCCCCCCCCNCOCCCCCCClCl/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;s9;d10;s10;s12;d13;s14;d15;d12s16;s17;s14;/rC:;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H13Cl2NO |
All Atoms: | 19 |
Heavy Atoms: | 19 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.73157 |
Area: | 471.533 |
Solvation: | -2.05675 |
Coulombic: | -22.7601 |
Bond Count [?]
All: | 20 |
Single: | 13 |
Double: | 7 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 294.175 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 4.9 |
LogP (Chemaxon): | 4.42 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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