1-(azepan-1-yl)-4-[5-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]butane-1,4-dione
Chemical Structure Depiction of
1-(azepan-1-yl)-4-[5-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]butane-1,4-dione
1-(azepan-1-yl)-4-[5-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]butane-1,4-dione
Compound characteristics
| Compound ID: | F325-1648 |
| Compound Name: | 1-(azepan-1-yl)-4-[5-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]butane-1,4-dione |
| Molecular Weight: | 433.57 |
| Molecular Formula: | C22 H31 N3 O4 S |
| Smiles: | C1CCCN(CC1)C(CCC(N1CCc2cc(ccc12)S(N1CCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3848 |
| logD: | 2.3847 |
| logSw: | -2.7784 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.19 |
| InChI Key: | YSPKPEZKGLUUDM-UHFFFAOYSA-N |