N-(6-cyano-2H-1,3-benzodioxol-5-yl)-4-methoxy-3-(pyrrolidine-1-sulfonyl)benzamide
Chemical Structure Depiction of
N-(6-cyano-2H-1,3-benzodioxol-5-yl)-4-methoxy-3-(pyrrolidine-1-sulfonyl)benzamide
N-(6-cyano-2H-1,3-benzodioxol-5-yl)-4-methoxy-3-(pyrrolidine-1-sulfonyl)benzamide
Compound characteristics
| Compound ID: | 8015-4319 |
| Compound Name: | N-(6-cyano-2H-1,3-benzodioxol-5-yl)-4-methoxy-3-(pyrrolidine-1-sulfonyl)benzamide |
| Molecular Weight: | 429.45 |
| Molecular Formula: | C20 H19 N3 O6 S |
| Smiles: | COc1ccc(cc1S(N1CCCC1)(=O)=O)C(Nc1cc2c(cc1C#N)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.373 |
| logD: | 1.6903 |
| logSw: | -3.1346 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.511 |
| InChI Key: | DCVHUTWNKOCLHA-UHFFFAOYSA-N |