N-[3-(benzenesulfonyl)-4,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-yl]-2-fluorobenzamide
Chemical Structure Depiction of
N-[3-(benzenesulfonyl)-4,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-yl]-2-fluorobenzamide
N-[3-(benzenesulfonyl)-4,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-yl]-2-fluorobenzamide
Compound characteristics
| Compound ID: | D715-2271 |
| Compound Name: | N-[3-(benzenesulfonyl)-4,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-yl]-2-fluorobenzamide |
| Molecular Weight: | 414.5 |
| Molecular Formula: | C22 H23 F N2 O3 S |
| Smiles: | CC(C)n1c(C)c(C)c(c1NC(c1ccccc1F)=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9287 |
| logD: | 3.69 |
| logSw: | -4.1166 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.547 |
| InChI Key: | ZWIGIJFGNUFGGC-UHFFFAOYSA-N |