1,2,5-trimethyl-N-[3-(methylsulfanyl)phenyl]-4-(piperidine-1-carbonyl)-1H-pyrrole-3-sulfonamide
Chemical Structure Depiction of
1,2,5-trimethyl-N-[3-(methylsulfanyl)phenyl]-4-(piperidine-1-carbonyl)-1H-pyrrole-3-sulfonamide
1,2,5-trimethyl-N-[3-(methylsulfanyl)phenyl]-4-(piperidine-1-carbonyl)-1H-pyrrole-3-sulfonamide
Compound characteristics
| Compound ID: | G243-0534 |
| Compound Name: | 1,2,5-trimethyl-N-[3-(methylsulfanyl)phenyl]-4-(piperidine-1-carbonyl)-1H-pyrrole-3-sulfonamide |
| Molecular Weight: | 421.58 |
| Molecular Formula: | C20 H27 N3 O3 S2 |
| Smiles: | Cc1c(C(N2CCCCC2)=O)c(c(C)n1C)S(Nc1cccc(c1)SC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8065 |
| logD: | 2.7773 |
| logSw: | -3.5093 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.315 |
| InChI Key: | RZOBEMCVALSPFX-UHFFFAOYSA-N |