Chemical ID: 7060795

c1ccc(c(c1)C2C(=C(C(=O)N2Cc3ccco3)O)C(=O)c4ccncc4)F
Chemical ID:
7060795
Name [?]:
5-(2-fluorophenyl)-1-(2-furylmethyl)-3-hydroxy-4-(4-pyridylcarbonyl)-5H-pyrrol-2-one
SMILES [?]:
c1ccc(c(c1)C2C(=C(C(=O)N2Cc3ccco3)O)C(=O)c4ccncc4)F
InChi [?]:
InChI=1/C21H15FN2O4/c22-16-6-2-1-5-15(16)18-17(19(25)13-7-9-23-10-8-13)20(26)21(27)24(18)12-14-4-3-11-28-14/h1-11,18,26H,12H2
InChi Info:
AuxInfo=1/0/N:1,2,16,15,6,3,23,27,24,26,17,13,22,14,5,4,8,7,20,9,10,28,25,12,21,19,11,18/E:(7,8)(9,10)/rA:28cCCCCCCCCCCONCCCCCOOCOCCCNCCF/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s9;d10;s7s10;s12;s13;d14;s15;d16;s14s17;s9;s8;d20;s20;s22;d23;s24;d25;d22s26;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H15FN2O4
All Atoms:43
Heavy Atoms:28
Chiral Atoms:None
ZAP Information [?]
Total:5.85906
Area:531.149
Solvation:-7.41966
Coulombic:-55.3864
Bond Count [?]
All:31
Single:20
Double:11
Rotors:5
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:2.51
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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