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Chemical ID: 7259029
Chemical ID:
7259029
Name [?]:
N-[4-[2-(3,4-dichlorophenoxy)acetyl]aminophenyl]acetamide
SMILES [?]:
CC(=O)Nc1ccc(cc1)NC(=O)COc2ccc(c(c2)Cl)Cl
InChi [?]:
InChI=1/C16H14Cl2N2O3/c1-10(21)19-11-2-4-12(5-3-11)20-16(22)9-23-13-6-7-14(17)15(18)8-13/h2-8H,9H2,1H3,(H,19,21)(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,6,10,7,9,17,18,21,14,2,5,8,16,19,20,12,23,22,4,11,3,13,15/E:(2,3)(4,5)/rA:23nCCONCCCCCCNCOCOCCCCCCClCl/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s8;s11;d12;s12;s14;s15;s16;d17;s18;d19;d16s20;s20;s19;/rC:;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H14Cl2N2O3 |
All Atoms: | 37 |
Heavy Atoms: | 23 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.53915 |
Area: | 563.724 |
Solvation: | -5.55396 |
Coulombic: | -46.5524 |
Bond Count [?]
All: | 24 |
Single: | 16 |
Double: | 8 |
Rotors: | 7 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 353.199 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 5 |
XLogP: | 2.75 |
LogP (Chemaxon): | 3.24 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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