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Chemical ID: 7360335
Chemical ID:
7360335
Name [?]:
N-[(2,4-dichlorophenyl)methyl]-N,2,4,6-tetramethyl-benzamide
SMILES [?]:
Cc1cc(c(c(c1)C)C(=O)N(C)Cc2ccc(cc2Cl)Cl)C
InChi [?]:
InChI=1/C18H19Cl2NO/c1-11-7-12(2)17(13(3)8-11)18(22)21(4)10-14-5-6-15(19)9-16(14)20/h5-9H,10H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,8,22,12,15,16,7,3,18,13,2,6,4,14,17,19,5,9,21,20,11,10/E:(2,3)(7,8)(12,13)/rA:22nCCCCCCCCCONCCCCCCCCClClC/rB:s1;s2;d3;s4;d5;d2s6;s6;s5;d9;s9;s11;s11;s13;s14;d15;s16;d17;d14s18;s19;s17;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H19Cl2NO |
All Atoms: | 41 |
Heavy Atoms: | 22 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 11.3041 |
Area: | 513.597 |
Solvation: | -1.53579 |
Coulombic: | -20.7154 |
Bond Count [?]
All: | 23 |
Single: | 16 |
Double: | 7 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 336.255 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 2 |
XLogP: | 5.83 |
LogP (Chemaxon): | 5.4 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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