Chemical ID: 4927981

c1ccc(cc1)C2=NC3c4ccccc4C2O3
Chemical ID:
4927981
Name [?]:
None
SMILES [?]:
c1ccc(cc1)C2=NC3c4ccccc4C2O3
InChi [?]:
InChI=1/C15H11NO/c1-2-6-10(7-3-1)13-14-11-8-4-5-9-12(11)15(16-13)17-14/h1-9,14-15H
InChi Info:
AuxInfo=1/0/N:1,2,6,13,12,3,5,14,11,4,15,10,7,16,9,8,17/E:(2,3)(6,7)/rA:17cCCCCCCCNCCCCCCCCO/rB:s1;d2;s3;d4;d1s5;s4;d7;s8;s9;s10;d11;s12;d13;d10s14;s7s15;s9s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H11NO
All Atoms:17
Heavy Atoms:17
Chiral Atoms:2
ZAP Information [?]
Total:7.38127
Area:391.951
Solvation:-2.4175
Coulombic:-17.8674
Bond Count [?]
All:20
Single:13
Double:7
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:221.254
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.61
LogP (Chemaxon):3.36

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