HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-(Methylamino)quinazoline-2,4(1H,3H)-dione
Identifiers & Physical Properties
| CAS No. | 62493-25-8 |
|---|---|
| Molecular formula | C9H9N3O2 |
| Average molar mass | 191.19 g/mol |
| Monoisotopic mass | 191.06947654 g/mol |
| SMILES | CNn1c(=O)[nH]c2ccccc2c1=O |
| InChIKey | IIJAQOJTXKCGGI-UHFFFAOYSA-N |
| PubChem CID | 12375037 |
| DTXSID | DTXSID50495048 |
Chemical & Physical Properties
| XLogP | 0.4 |
|---|---|
| Topological polar surface area | 61.4 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 1 |
| Heavy atoms | 14 |
| Formal charge | 0 |
| Complexity | 267 |