N-[1-(3-methoxypropyl)-4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1H-pyrrol-2-yl]-2-methylpropanamide
Chemical Structure Depiction of
N-[1-(3-methoxypropyl)-4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1H-pyrrol-2-yl]-2-methylpropanamide
N-[1-(3-methoxypropyl)-4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1H-pyrrol-2-yl]-2-methylpropanamide
Compound characteristics
| Compound ID: | D715-2087 |
| Compound Name: | N-[1-(3-methoxypropyl)-4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1H-pyrrol-2-yl]-2-methylpropanamide |
| Molecular Weight: | 406.54 |
| Molecular Formula: | C21 H30 N2 O4 S |
| Smiles: | CC(C)C(Nc1c(c(C)c(C)n1CCCOC)S(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5911 |
| logD: | 3.5854 |
| logSw: | -3.7111 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.064 |
| InChI Key: | NNYROONXNXOEJT-UHFFFAOYSA-N |