Chemical ID: 6525223

Cc1cc(c2ccccc2n1)NC(=O)Nc3ccc(cc3)F
Chemical ID:
6525223
Name [?]:
3-(4-fluorophenyl)-1-(2-methyl-4-quinolyl)-urea
SMILES [?]:
Cc1cc(c2ccccc2n1)NC(=O)Nc3ccc(cc3)F
InChi [?]:
InChI=1/C17H14FN3O/c1-11-10-16(14-4-2-3-5-15(14)19-11)21-17(22)20-13-8-6-12(18)7-9-13/h2-10H,1H3,(H2,19,20,21,22)
InChi Info:
AuxInfo=1/1/N:1,7,8,6,9,18,20,17,21,3,2,19,16,5,10,4,13,22,11,15,12,14/E:(6,7)(8,9)/rA:22nCCCCCCCCCCNNCONCCCCCCF/rB:s1;s2;d3;s4;s5;d6;s7;d8;d5s9;d2s10;s4;s12;d13;s13;s15;s16;d17;s18;d19;d16s20;s19;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H14FN3O
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:8.81809
Area:476.523
Solvation:-3.09499
Coulombic:-43.388
Bond Count [?]
All:24
Single:15
Double:9
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:295.311
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:3.06
LogP (Chemaxon):3.91

Name Annotations

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Descriptor Annotations

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