1,3-dimethyl-N-[(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methyl]-1H-pyrazole-4-sulfonamide
Chemical Structure Depiction of
1,3-dimethyl-N-[(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methyl]-1H-pyrazole-4-sulfonamide
1,3-dimethyl-N-[(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methyl]-1H-pyrazole-4-sulfonamide
Compound characteristics
| Compound ID: | Y504-5091 |
| Compound Name: | 1,3-dimethyl-N-[(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methyl]-1H-pyrazole-4-sulfonamide |
| Molecular Weight: | 325.45 |
| Molecular Formula: | C14 H19 N3 O2 S2 |
| Smiles: | Cc1c(cn(C)n1)S(NCc1cc2CCCCc2s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0162 |
| logD: | 1.9954 |
| logSw: | -2.4485 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.098 |
| InChI Key: | GPAPRMJIHBCRGL-UHFFFAOYSA-N |