2,2-dimethyl-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]propanamide
Chemical Structure Depiction of
2,2-dimethyl-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]propanamide
2,2-dimethyl-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]propanamide
Compound characteristics
| Compound ID: | 3388-0677 |
| Compound Name: | 2,2-dimethyl-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]propanamide |
| Molecular Weight: | 306.34 |
| Molecular Formula: | C13 H14 N4 O3 S |
| Smiles: | CC(C)(C)C(Nc1nnc(c2ccc(cc2)[N+]([O-])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3476 |
| logD: | 3.347 |
| logSw: | -3.623 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.256 |
| InChI Key: | MHHGMULXFMEBHA-UHFFFAOYSA-N |