N-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-1H-indol-3-yl)-3-methylbenzamide
Chemical Structure Depiction of
N-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-1H-indol-3-yl)-3-methylbenzamide
N-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-1H-indol-3-yl)-3-methylbenzamide
Compound characteristics
| Compound ID: | L881-0901 |
| Compound Name: | N-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-1H-indol-3-yl)-3-methylbenzamide |
| Molecular Weight: | 496.57 |
| Molecular Formula: | C29 H28 N4 O4 |
| Smiles: | Cc1cccc(c1)C(Nc1c2ccccc2[nH]c1C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3811 |
| logD: | 2.9006 |
| logSw: | -3.6242 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.358 |
| InChI Key: | NDATXFSHNBSPPL-UHFFFAOYSA-N |