N-[3-(benzenesulfonyl)-4,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-2-yl]pyridine-4-carboxamide
Chemical Structure Depiction of
N-[3-(benzenesulfonyl)-4,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-2-yl]pyridine-4-carboxamide
N-[3-(benzenesulfonyl)-4,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-2-yl]pyridine-4-carboxamide
Compound characteristics
| Compound ID: | D715-2136 |
| Compound Name: | N-[3-(benzenesulfonyl)-4,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-2-yl]pyridine-4-carboxamide |
| Molecular Weight: | 395.48 |
| Molecular Formula: | C21 H21 N3 O3 S |
| Smiles: | Cc1c(c(NC(c2ccncc2)=O)n(CC=C)c1C)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6463 |
| logD: | 2.2451 |
| logSw: | -3.0605 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.878 |
| InChI Key: | RPBSDXMWLNDVFV-UHFFFAOYSA-N |