N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(pyrrolidine-1-sulfonyl)-4-(pyrrolidin-1-yl)benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(pyrrolidine-1-sulfonyl)-4-(pyrrolidin-1-yl)benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(pyrrolidine-1-sulfonyl)-4-(pyrrolidin-1-yl)benzamide
Compound characteristics
| Compound ID: | G554-0443 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(pyrrolidine-1-sulfonyl)-4-(pyrrolidin-1-yl)benzamide |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C23 H27 N3 O5 S |
| Smiles: | C1CCN(C1)c1ccc(cc1S(N1CCCC1)(=O)=O)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1277 |
| logD: | 3.1277 |
| logSw: | -3.5406 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.362 |
| InChI Key: | VLAOZARYENJSLL-UHFFFAOYSA-N |