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 | |
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Formal Charge | 0 |
Atom Count | 33 |
Chiral Atom Count | 0 |
Bond Count | 35 |
Aromatic Bond Count | 17 |
Chemical Component Summary | |
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Name | 4-(2-azanyl-8-methoxy-quinazolin-6-yl)phenol |
Systematic Name (OpenEye OEToolkits) | 4-(2-azanyl-8-methoxy-quinazolin-6-yl)phenol |
Formula | C15 H13 N3 O2 |
Molecular Weight | 267.283 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | COc1cc(cc2cnc(N)nc12)c3ccc(O)cc3 |
SMILES | OpenEye OEToolkits | 2.0.7 | COc1cc(cc2c1nc(nc2)N)c3ccc(cc3)O |
Canonical SMILES | CACTVS | 3.385 | COc1cc(cc2cnc(N)nc12)c3ccc(O)cc3 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | COc1cc(cc2c1nc(nc2)N)c3ccc(cc3)O |
InChI | InChI | 1.06 | 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) |
InChIKey | InChI | 1.06 | XMZXPVWZSUCWOA-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 162423120 |