{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[1-(1-ethyl-1H-imidazole-4-sulfonyl)piperidin-3-yl]methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[1-(1-ethyl-1H-imidazole-4-sulfonyl)piperidin-3-yl]methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[1-(1-ethyl-1H-imidazole-4-sulfonyl)piperidin-3-yl]methanone
Compound characteristics
| Compound ID: | G404-2501 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[1-(1-ethyl-1H-imidazole-4-sulfonyl)piperidin-3-yl]methanone |
| Molecular Weight: | 489.59 |
| Molecular Formula: | C23 H31 N5 O5 S |
| Smiles: | CCn1cc(nc1)S(N1CCCC(C1)C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1072 |
| logD: | 0.6389 |
| logSw: | -2.3525 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.021 |
| InChI Key: | NDNKZEWWUOCOCY-IBGZPJMESA-N |