N-(3-carbamoyl-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-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
N-(3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y501-8774 |
| Compound Name: | N-(3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 386.39 |
| Molecular Formula: | C16 H17 F3 N4 O2 S |
| Smiles: | CC1CCc2c(C(N)=O)c(NC(c3cc(C(F)(F)F)nn3C)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8434 |
| logD: | 0.3771 |
| logSw: | -2.6488 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.619 |
| InChI Key: | MVLLXYJIHDEVHD-SSDOTTSWSA-N |