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Chemical ID: 7520276
Chemical ID:
7520276
Name [?]:
3-acetamido-N-(4-fluorophenyl)-4-methyl-benzamide
SMILES [?]:
Cc1ccc(cc1NC(=O)C)C(=O)Nc2ccc(cc2)F
InChi [?]:
InChI=1/C16H15FN2O2/c1-10-3-4-12(9-15(10)18-11(2)20)16(21)19-14-7-5-13(17)6-8-14/h3-9H,1-2H3,(H,18,20)(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,11,3,4,17,19,16,20,6,2,9,5,18,15,7,12,21,8,14,10,13/E:(5,6)(7,8)/rA:21nCCCCCCCNCOCCONCCCCCCF/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s5;d12;s12;s14;s15;d16;s17;d18;d15s19;s18;/rC:;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H15FN2O2 |
All Atoms: | 36 |
Heavy Atoms: | 21 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 7.89312 |
Area: | 476.228 |
Solvation: | -4.01257 |
Coulombic: | -44.0762 |
Bond Count [?]
All: | 22 |
Single: | 14 |
Double: | 8 |
Rotors: | 5 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 2.63 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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