9XT
3-[(4-azanyl-3-methyl-phenyl)methyl]-7-(furan-2-yl)-[1,2,3]triazolo[4,5-d]pyrimidin-5-amine
Find entries where: 9XT
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | 3-[(4-azanyl-3-methyl-phenyl)methyl]-7-(furan-2-yl)-[1,2,3]triazolo[4,5-d]pyrimidin-5-amine |
| Identifiers | 3-[(4-azanyl-3-methyl-phenyl)methyl]-7-(furan-2-yl)-[1,2,3]triazolo[4,5-d]pyrimidin-5-amine |
| Formula | C16 H15 N7 O |
| Molecular Weight | 321.337 |
| Type | NON-POLYMER |
| Isomeric SMILES | Cc1cc(ccc1N)Cn2c3c(c(nc(n3)N)c4ccco4)nn2 |
| InChI | InChI=1S/C16H15N7O/c1-9-7-10(4-5-11(9)17)8-23-15-14(21-22-23)13(19-16(18)20-15)12-3-2-6-24-12/h2-7H,8,17H2,1H3,(H2,18,19,20) |
| InChIKey | HQSBCDPYXDGTCL-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 39 |
| Chiral Atom Count | 0 |
| Bond Count | 42 |
| Aromatic Bond Count | 21 |
Drug Info: DrugBank
| DrugBank ID | DB06625? |
|---|---|
| Name | Vipadenant |
| Groups | investigational |
| Synonyms | Vipadenant |
| Indication | Investigated for use/treatment in parkinson's disease. |
| Categories |
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| CAS number | 442908-10-3 |
Related Resource References
| Resource Name | Reference |
|---|---|
| Pharos | CHEMBL447664 |
| PubChem | 21874557 |
| ChEMBL | CHEMBL447664 |
