2-fluoro-N-[3-(4-methoxybenzene-1-sulfonyl)-4,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-2-yl]benzamide
Chemical Structure Depiction of
2-fluoro-N-[3-(4-methoxybenzene-1-sulfonyl)-4,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-2-yl]benzamide
2-fluoro-N-[3-(4-methoxybenzene-1-sulfonyl)-4,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-2-yl]benzamide
Compound characteristics
| Compound ID: | D715-2045 |
| Compound Name: | 2-fluoro-N-[3-(4-methoxybenzene-1-sulfonyl)-4,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-2-yl]benzamide |
| Molecular Weight: | 442.51 |
| Molecular Formula: | C23 H23 F N2 O4 S |
| Smiles: | Cc1c(c(NC(c2ccccc2F)=O)n(CC=C)c1C)S(c1ccc(cc1)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0457 |
| logD: | 3.5046 |
| logSw: | -4.268 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.994 |
| InChI Key: | IJVCHOLYDVIHCW-UHFFFAOYSA-N |