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Chemical ID: 5144826
Chemical ID:
5144826
Name [?]:
3-phenylquinolin-4-ol
SMILES [?]:
c1ccc(cc1)c2cnc3ccccc3c2O
InChi [?]:
InChI=1/C15H11NO/c17-15-12-8-4-5-9-14(12)16-10-13(15)11-6-2-1-3-7-11/h1-10H,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,2,6,13,12,3,5,14,11,8,4,15,7,10,16,9,17/E:(2,3)(6,7)/rA:17nCCCCCCCCNCCCCCCCO/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s9;s10;d11;s12;d13;d10s14;d7s15;s16;/rC:;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H11NO |
All Atoms: | 17 |
Heavy Atoms: | 17 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.89048 |
Area: | 391.06 |
Solvation: | -1.88602 |
Coulombic: | -24.286 |
Bond Count [?]
All: | 19 |
Single: | 11 |
Double: | 8 |
Rotors: | 1 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 221.254 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 1 |
XLogP: | 3.66 |
LogP (Chemaxon): | 3.54 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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