Chemical ID: 5034368

c1ccc2c(c1)-c3ccccc3C24CNC(=O)O4
Chemical ID:
5034368
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)-c3ccccc3C24CNC(=O)O4
InChi [?]:
InChI=1/C15H11NO2/c17-14-16-9-15(18-14)12-7-3-1-5-10(12)11-6-2-4-8-13(11)15/h1-8H,9H2,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,9,2,10,6,8,3,11,14,5,7,4,12,16,13,15,17,18/E:(1,2)(3,4)(5,6)(7,8)(10,11)(12,13)/rA:18nCCCCCCCCCCCCCCNCOO/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s9;d10;d7s11;s4s12;s13;s14;s15;d16;s13s16;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H11NO2
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:7.63234
Area:395.759
Solvation:-2.26165
Coulombic:-36.5555
Bond Count [?]
All:21
Single:14
Double:7
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:237.253
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.96
LogP (Chemaxon):2.68

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