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Chemical ID: 5623474
Chemical ID:
5623474
Name [?]:
N-(2-fluorophenyl)-4-phenyl-benzamide
SMILES [?]:
c1ccc(cc1)c2ccc(cc2)C(=O)Nc3ccccc3F
InChi [?]:
InChI=1/C19H14FNO/c20-17-8-4-5-9-18(17)21-19(22)16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-13H,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,2,6,19,18,3,5,20,17,8,12,9,11,4,7,10,21,16,13,22,15,14/E:(2,3)(6,7)(10,11)(12,13)/rA:22nCCCCCCCCCCCCCONCCCCCCF/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s9;d10;d7s11;s10;d13;s13;s15;s16;d17;s18;d19;d16s20;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C19H14FNO |
All Atoms: | 22 |
Heavy Atoms: | 22 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.75327 |
Area: | 488.97 |
Solvation: | -2.47098 |
Coulombic: | -29.5814 |
Bond Count [?]
All: | 24 |
Single: | 14 |
Double: | 10 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 291.319 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 5.09 |
LogP (Chemaxon): | 4.28 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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