(2-{[4-(2H-1,3-benzodioxole-5-carbonyl)piperazin-1-yl]methyl}-1-methyl-1H-benzimidazol-5-yl)(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
(2-{[4-(2H-1,3-benzodioxole-5-carbonyl)piperazin-1-yl]methyl}-1-methyl-1H-benzimidazol-5-yl)(pyrrolidin-1-yl)methanone
(2-{[4-(2H-1,3-benzodioxole-5-carbonyl)piperazin-1-yl]methyl}-1-methyl-1H-benzimidazol-5-yl)(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | L275-0106 |
| Compound Name: | (2-{[4-(2H-1,3-benzodioxole-5-carbonyl)piperazin-1-yl]methyl}-1-methyl-1H-benzimidazol-5-yl)(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 475.55 |
| Molecular Formula: | C26 H29 N5 O4 |
| Smiles: | Cn1c2ccc(cc2nc1CN1CCN(CC1)C(c1ccc2c(c1)OCO2)=O)C(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5421 |
| logD: | 1.0974 |
| logSw: | -2.1241 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.543 |
| InChI Key: | KJXJWWUNBRMKBO-UHFFFAOYSA-N |