N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(difluoromethyl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(difluoromethyl)-1H-pyrazole-5-carboxamide
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(difluoromethyl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y500-1623 |
| Compound Name: | N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(difluoromethyl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 322.33 |
| Molecular Formula: | C14 H12 F2 N4 O S |
| Smiles: | C1CCc2c(C1)c(C#N)c(NC(c1ccnn1C(F)F)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.3487 |
| logD: | -2.0497 |
| logSw: | -2.8954 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.851 |
| InChI Key: | HCILBQVNRDKIJA-UHFFFAOYSA-N |