4-bromo-N-(3-carbamoyl-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-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
4-bromo-N-(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y500-2412 |
| Compound Name: | 4-bromo-N-(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 437.24 |
| Molecular Formula: | C14 H12 Br F3 N4 O2 S |
| Smiles: | Cn1c(C(Nc2c(C(N)=O)c3CCCc3s2)=O)c(c(C(F)(F)F)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.5473 |
| logD: | -0.8657 |
| logSw: | -2.1673 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 71.532 |
| InChI Key: | KIWCEJUFTYFUHV-UHFFFAOYSA-N |