1-[5-(azepane-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]-4-(pyrrolidin-1-yl)butane-1,4-dione
Chemical Structure Depiction of
1-[5-(azepane-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]-4-(pyrrolidin-1-yl)butane-1,4-dione
1-[5-(azepane-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]-4-(pyrrolidin-1-yl)butane-1,4-dione
Compound characteristics
| Compound ID: | F325-0061 |
| Compound Name: | 1-[5-(azepane-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]-4-(pyrrolidin-1-yl)butane-1,4-dione |
| Molecular Weight: | 433.57 |
| Molecular Formula: | C22 H31 N3 O4 S |
| Smiles: | C1CCCN(CC1)S(c1ccc2c(CCN2C(CCC(N2CCCC2)=O)=O)c1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4963 |
| logD: | 2.4963 |
| logSw: | -2.8062 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.19 |
| InChI Key: | OJJHLPNTHUNLIR-UHFFFAOYSA-N |