DQU
Summary
| Name: | 2,6-DIAMINO-3H-QUINAZOLIN-4-ONE |
| Synonyms: | 2,6-DIAMINOQUINAZOLIN-4(3H)-ONE |
| Formula: | C8 H8 N4 O |
| Formal charge: | 0 |
| Formula weight: | 176.175 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2,6-diaminoquinazolin-4-ol |
| OpenEye OEToolkits | 1.5.0 | 2,6-diaminoquinazolin-4-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n2c1c(cc(cc1)N)c(O)nc2N |
| SMILES_CANONICAL | CACTVS | 3.341 | Nc1ccc2nc(N)nc(O)c2c1 |
| SMILES | CACTVS | 3.341 | Nc1ccc2nc(N)nc(O)c2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1N)c(nc(n2)N)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1N)c(nc(n2)N)O |
| InChI | InChI | 1.03 | InChI=1S/C8H8N4O/c9-4-1-2-6-5(3-4)7(13)12-8(10)11-6/h1-3H,9H2,(H3,10,11,12,13) |
| InChIKey | InChI | 1.03 | YCRCNZBZUQLULA-UHFFFAOYSA-N |
