Chemical ID: 4152992

c1ccc2c(c1)c(nc(n2)c3cccnc3)O
Chemical ID:
4152992
Name [?]:
2-(3-pyridyl)quinazolin-4-ol
SMILES [?]:
c1ccc2c(c1)c(nc(n2)c3cccnc3)O
InChi [?]:
InChI=1/C13H9N3O/c17-13-10-5-1-2-6-11(10)15-12(16-13)9-4-3-7-14-8-9/h1-8H,(H,15,16,17)
InChi Info:
AuxInfo=1/1/N:1,2,13,12,6,3,14,16,11,5,4,9,7,15,10,8,17/rA:17nCCCCCCCNCNCCCCNCO/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s9;s11;d12;s13;d14;d11s15;s7;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H9N3O
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:7.55993
Area:393.346
Solvation:-2.27372
Coulombic:-34.1442
Bond Count [?]
All:19
Single:11
Double:8
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:223.23
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:2.18
LogP (Chemaxon):2.46

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Descriptor Annotations

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