N-[1-(2-methoxyethyl)-4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1H-pyrrol-2-yl]-3-methylbenzamide
Chemical Structure Depiction of
N-[1-(2-methoxyethyl)-4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1H-pyrrol-2-yl]-3-methylbenzamide
N-[1-(2-methoxyethyl)-4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1H-pyrrol-2-yl]-3-methylbenzamide
Compound characteristics
| Compound ID: | D715-2073 |
| Compound Name: | N-[1-(2-methoxyethyl)-4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1H-pyrrol-2-yl]-3-methylbenzamide |
| Molecular Weight: | 440.56 |
| Molecular Formula: | C24 H28 N2 O4 S |
| Smiles: | Cc1ccc(cc1)S(c1c(C)c(C)n(CCOC)c1NC(c1cccc(C)c1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2363 |
| logD: | 3.9777 |
| logSw: | -4.1579 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.792 |
| InChI Key: | XBTVKHSCXZOJDB-UHFFFAOYSA-N |