4-bromo-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
4-bromo-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
4-bromo-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y500-2403 |
| Compound Name: | 4-bromo-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 419.22 |
| Molecular Formula: | C14 H10 Br F3 N4 O S |
| Smiles: | Cn1c(C(Nc2c(C#N)c3CCCc3s2)=O)c(c(C(F)(F)F)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.2302 |
| logD: | -0.222 |
| logSw: | -3.6501 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.529 |
| InChI Key: | ZEPXMLZZNACGHK-UHFFFAOYSA-N |