2-oxo-2-[(1,3,4-thiadiazol-2-yl)amino]ethyl 4-nitrobenzoate
Chemical Structure Depiction of
2-oxo-2-[(1,3,4-thiadiazol-2-yl)amino]ethyl 4-nitrobenzoate
2-oxo-2-[(1,3,4-thiadiazol-2-yl)amino]ethyl 4-nitrobenzoate
Compound characteristics
| Compound ID: | 8008-5614 |
| Compound Name: | 2-oxo-2-[(1,3,4-thiadiazol-2-yl)amino]ethyl 4-nitrobenzoate |
| Molecular Weight: | 308.27 |
| Molecular Formula: | C11 H8 N4 O5 S |
| Smiles: | C(C(Nc1nncs1)=O)OC(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7455 |
| logD: | 1.7426 |
| logSw: | -2.4983 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.203 |
| InChI Key: | QIQKQOBCJXRQST-UHFFFAOYSA-N |