N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-(difluoromethyl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-(difluoromethyl)-1H-pyrazole-5-carboxamide
N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-(difluoromethyl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y500-1622 |
| Compound Name: | N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-(difluoromethyl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 336.36 |
| Molecular Formula: | C15 H14 F2 N4 O S |
| Smiles: | C1CCc2c(C#N)c(NC(c3ccnn3C(F)F)=O)sc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.8446 |
| logD: | -1.5538 |
| logSw: | -3.4339 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.182 |
| InChI Key: | MXADSWRDPLHKHJ-UHFFFAOYSA-N |