4-bromo-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,5-dimethyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
4-bromo-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,5-dimethyl-1H-pyrazole-3-carboxamide
4-bromo-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,5-dimethyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y500-4650 |
| Compound Name: | 4-bromo-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,5-dimethyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 362.27 |
| Molecular Formula: | C10 H12 Br N5 O S2 |
| Smiles: | CCSc1nnc(NC(c2c(c(C)n(C)n2)[Br])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.7797 |
| logD: | 2.7094 |
| logSw: | -3.0173 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.269 |
| InChI Key: | HVUBACLXWSPJFB-UHFFFAOYSA-N |