3-(4-{[1-(1-methyl-1H-imidazole-4-sulfonyl)piperidin-4-yl]methyl}phenyl)-1-(pyrrolidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-(4-{[1-(1-methyl-1H-imidazole-4-sulfonyl)piperidin-4-yl]methyl}phenyl)-1-(pyrrolidin-1-yl)propan-1-one
3-(4-{[1-(1-methyl-1H-imidazole-4-sulfonyl)piperidin-4-yl]methyl}phenyl)-1-(pyrrolidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | S787-1482 |
| Compound Name: | 3-(4-{[1-(1-methyl-1H-imidazole-4-sulfonyl)piperidin-4-yl]methyl}phenyl)-1-(pyrrolidin-1-yl)propan-1-one |
| Molecular Weight: | 444.6 |
| Molecular Formula: | C23 H32 N4 O3 S |
| Smiles: | Cn1cc(nc1)S(N1CCC(CC1)Cc1ccc(CCC(N2CCCC2)=O)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7986 |
| logD: | 2.7986 |
| logSw: | -3.2158 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.576 |
| InChI Key: | HBYWFDIKBJAFKW-UHFFFAOYSA-N |