5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-2-methoxy-N-(propan-2-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-2-methoxy-N-(propan-2-yl)benzene-1-sulfonamide
5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-2-methoxy-N-(propan-2-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y050-2347 |
| Compound Name: | 5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-2-methoxy-N-(propan-2-yl)benzene-1-sulfonamide |
| Molecular Weight: | 475.56 |
| Molecular Formula: | C23 H29 N3 O6 S |
| Smiles: | CC(C)NS(c1cc(ccc1OC)C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9243 |
| logD: | 1.7326 |
| logSw: | -2.8855 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.391 |
| InChI Key: | AESPPUYHPRMYHM-UHFFFAOYSA-N |