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Chemical ID: 6283068
Chemical ID:
6283068
Name [?]:
4-fluoro-N-(5-phenyl-1,3,4-oxadiazol-2-yl)-benzamide
SMILES [?]:
c1ccc(cc1)c2nnc(o2)NC(=O)c3ccc(cc3)F
InChi [?]:
InChI=1/C15H10FN3O2/c16-12-8-6-10(7-9-12)13(20)17-15-19-18-14(21-15)11-4-2-1-3-5-11/h1-9H,(H,17,19,20)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,16,20,17,19,15,4,18,13,7,10,21,12,8,9,14,11/E:(2,3)(4,5)(6,7)(8,9)/rA:21nCCCCCCCNNCONCOCCCCCCF/rB:s1;d2;s3;d4;d1s5;s4;d7;s8;d9;s7s10;s10;s12;d13;s13;s15;d16;s17;d18;d15s19;s18;/rC:;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H10FN3O2 |
All Atoms: | 21 |
Heavy Atoms: | 21 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.47071 |
Area: | 471.303 |
Solvation: | -3.31187 |
Coulombic: | -41.5879 |
Bond Count [?]
All: | 23 |
Single: | 14 |
Double: | 9 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 283.257 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 4.52 |
LogP (Chemaxon): | 3.01 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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