N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y501-8778 |
| Compound Name: | N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 368.38 |
| Molecular Formula: | C16 H15 F3 N4 O S |
| Smiles: | CC1CCc2c(C#N)c(NC(c3cc(C(F)(F)F)nn3C)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5262 |
| logD: | 1.0329 |
| logSw: | -4.1257 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.617 |
| InChI Key: | YMQPCMIRSKAXQU-MRVPVSSYSA-N |