HuagongsheHuagongshe Chemistry Print Report · For research reference only
Ethyl 4,5-dimethylthiazol-2-ylcarbamoylcarboxylate
Identifiers & Physical Properties
| Molecular formula | C9H12N2O3S |
|---|---|
| Average molar mass | 228.27 g/mol |
| Monoisotopic mass | 228.05686342 g/mol |
| SMILES | CCOC(=O)C(=O)Nc1nc(C)c(C)s1 |
| InChIKey | VAIGQVYERRLKSN-UHFFFAOYSA-N |
| PubChem CID | 12831776 |
| ChEMBL | CHEMBL16097 |
Chemical & Physical Properties
| XLogP | 1.9 |
|---|---|
| Topological polar surface area | 96.5 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 5 |
| Rotatable bonds | 4 |
| Heavy atoms | 15 |
| Formal charge | 0 |
| Complexity | 260 |