4-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethoxy)-3-methyl-N-(propan-2-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethoxy)-3-methyl-N-(propan-2-yl)benzene-1-sulfonamide
4-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethoxy)-3-methyl-N-(propan-2-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y050-0757 |
| Compound Name: | 4-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethoxy)-3-methyl-N-(propan-2-yl)benzene-1-sulfonamide |
| Molecular Weight: | 489.59 |
| Molecular Formula: | C24 H31 N3 O6 S |
| Smiles: | CC(C)NS(c1ccc(c(C)c1)OCC(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5985 |
| logD: | 2.2989 |
| logSw: | -3.0586 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.818 |
| InChI Key: | SAEBWBBOYMILOK-UHFFFAOYSA-N |