2-[5-amino-4-(methanesulfonyl)-3-(methylsulfanyl)-1H-pyrazol-1-yl]-N-(4-bromophenyl)acetamide
Chemical Structure Depiction of
2-[5-amino-4-(methanesulfonyl)-3-(methylsulfanyl)-1H-pyrazol-1-yl]-N-(4-bromophenyl)acetamide
2-[5-amino-4-(methanesulfonyl)-3-(methylsulfanyl)-1H-pyrazol-1-yl]-N-(4-bromophenyl)acetamide
Compound characteristics
| Compound ID: | G196-0230 |
| Compound Name: | 2-[5-amino-4-(methanesulfonyl)-3-(methylsulfanyl)-1H-pyrazol-1-yl]-N-(4-bromophenyl)acetamide |
| Molecular Weight: | 419.32 |
| Molecular Formula: | C13 H15 Br N4 O3 S2 |
| Smiles: | CSc1c(c(N)n(CC(Nc2ccc(cc2)[Br])=O)n1)S(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2523 |
| logD: | 1.2522 |
| logSw: | -2.3564 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.224 |
| InChI Key: | HJBQGXTZDBJDDO-UHFFFAOYSA-N |