Chemical ID: 7124541

Cc1cc(nc(n1)Nc2[nH+]cc(n2c3ccccc3)O)C
Chemical ID:
7124541
Name [?]:
2-(4,6-dimethylpyrimidin-2-yl)amino-3-phenyl-1H-imidazol-4-ol
SMILES [?]:
Cc1cc(nc(n1)Nc2[nH+]cc(n2c3ccccc3)O)C
InChi [?]:
InChI=1/C15H15N5O/c1-10-8-11(2)18-14(17-10)19-15-16-9-13(21)20(15)12-6-4-3-5-7-12/h3-9,21H,1-2H3,(H,16,17,18,19)/p+1
InChi Info:
AuxInfo=1/1/N:1,21,17,16,18,15,19,3,11,2,4,14,12,6,9,10,7,5,8,13,20/E:(1,2)(4,5)(6,7)(10,11)(17,18)/rA:21nCCCCNCNNCN+CCNCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s10;d11;s9s12;s13;s14;d15;s16;d17;d14s18;s12;s4;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H16N5O+
All Atoms:37
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:-19.0561
Area:474.796
Solvation:-30.926
Coulombic:-42.0198
Bond Count [?]
All:23
Single:15
Double:8
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:282.321
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:3.12
LogP (Chemaxon):2.12

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Descriptor Annotations

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