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Chemical ID: 7285107
Chemical ID:
7285107
Name [?]:
N-(2-acetylphenyl)-2,4-dimethyl-benzamide
SMILES [?]:
Cc1ccc(c(c1)C)C(=O)Nc2ccccc2C(=O)C
InChi [?]:
InChI=1/C17H17NO2/c1-11-8-9-14(12(2)10-11)17(20)18-16-7-5-4-6-15(16)13(3)19/h4-10H,1-3H3,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,8,20,15,14,16,13,3,4,7,2,6,18,5,17,12,9,11,19,10/rA:20nCCCCCCCCCONCCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;s5;d9;s9;s11;s12;d13;s14;d15;d12s16;s17;d18;s18;/rC:;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C17H17NO2 |
All Atoms: | 37 |
Heavy Atoms: | 20 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.04201 |
Area: | 459.928 |
Solvation: | -2.45619 |
Coulombic: | -30.5707 |
Bond Count [?]
All: | 21 |
Single: | 13 |
Double: | 8 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 267.322 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 4.14 |
LogP (Chemaxon): | 4.0 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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