N-(4-methylphenyl)-1,1-dioxo-3-(pyrrolidin-1-yl)-1H-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-(4-methylphenyl)-1,1-dioxo-3-(pyrrolidin-1-yl)-1H-1-benzothiophene-2-carboxamide
N-(4-methylphenyl)-1,1-dioxo-3-(pyrrolidin-1-yl)-1H-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | J087-0245 |
| Compound Name: | N-(4-methylphenyl)-1,1-dioxo-3-(pyrrolidin-1-yl)-1H-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 368.45 |
| Molecular Formula: | C20 H20 N2 O3 S |
| Smiles: | Cc1ccc(cc1)NC(C1=C(c2ccccc2S1(=O)=O)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5017 |
| logD: | 3.5016 |
| logSw: | -3.7706 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.333 |
| InChI Key: | RKVHTHWMOPXXCX-UHFFFAOYSA-N |