(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}piperidin-1-yl)(4-methyl-4H-thieno[3,2-b]pyrrol-5-yl)methanone
Chemical Structure Depiction of
(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}piperidin-1-yl)(4-methyl-4H-thieno[3,2-b]pyrrol-5-yl)methanone
(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}piperidin-1-yl)(4-methyl-4H-thieno[3,2-b]pyrrol-5-yl)methanone
Compound characteristics
| Compound ID: | C779-1553 |
| Compound Name: | (4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}piperidin-1-yl)(4-methyl-4H-thieno[3,2-b]pyrrol-5-yl)methanone |
| Molecular Weight: | 494.61 |
| Molecular Formula: | C26 H30 N4 O4 S |
| Smiles: | Cn1c(cc2c1ccs2)C(N1CCC(CC1)C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5385 |
| logD: | 2.0701 |
| logSw: | -2.8473 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.745 |
| InChI Key: | UKJZJKILPNLCLV-UHFFFAOYSA-N |