N-[1-(3-methoxypropyl)-4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1H-pyrrol-2-yl]cyclohexanecarboxamide
Chemical Structure Depiction of
N-[1-(3-methoxypropyl)-4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1H-pyrrol-2-yl]cyclohexanecarboxamide
N-[1-(3-methoxypropyl)-4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1H-pyrrol-2-yl]cyclohexanecarboxamide
Compound characteristics
| Compound ID: | D715-2085 |
| Compound Name: | N-[1-(3-methoxypropyl)-4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1H-pyrrol-2-yl]cyclohexanecarboxamide |
| Molecular Weight: | 446.61 |
| Molecular Formula: | C24 H34 N2 O4 S |
| Smiles: | Cc1ccc(cc1)S(c1c(C)c(C)n(CCCOC)c1NC(C1CCCCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3543 |
| logD: | 4.3405 |
| logSw: | -4.1056 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.984 |
| InChI Key: | SWCNDOFEFKBBKQ-UHFFFAOYSA-N |