9I5

4-(2-azanyl-8-methoxy-quinazolin-6-yl)phenol

Created: 2021-11-11
Last modified:  2022-08-22

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Chemical Details

Formal Charge0
Atom Count33
Chiral Atom Count0
Bond Count35
Aromatic Bond Count17
2D diagram of 9I5

Chemical Component Summary

Name4-(2-azanyl-8-methoxy-quinazolin-6-yl)phenol
Systematic Name (OpenEye OEToolkits)4-(2-azanyl-8-methoxy-quinazolin-6-yl)phenol
FormulaC15 H13 N3 O2
Molecular Weight267.283
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385COc1cc(cc2cnc(N)nc12)c3ccc(O)cc3
SMILESOpenEye OEToolkits2.0.7COc1cc(cc2c1nc(nc2)N)c3ccc(cc3)O
Canonical SMILESCACTVS3.385 COc1cc(cc2cnc(N)nc12)c3ccc(O)cc3
Canonical SMILESOpenEye OEToolkits2.0.7 COc1cc(cc2c1nc(nc2)N)c3ccc(cc3)O
InChIInChI1.06 InChI=1S/C15H13N3O2/c1-20-13-7-10(9-2-4-12(19)5-3-9)6-11-8-17-15(16)18-14(11)13/h2-8,19H,1H3,(H2,16,17,18)
InChIKeyInChI1.06 XMZXPVWZSUCWOA-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 162423120