3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-2(3H)-one
3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | F943-0076 |
| Compound Name: | 3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 395.5 |
| Molecular Formula: | C17 H21 N3 O4 S2 |
| Smiles: | C1CCN(C1)C(CN1C(=O)Sc2cc(ccc12)S(N1CCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1153 |
| logD: | 2.1153 |
| logSw: | -2.8772 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 64.647 |
| InChI Key: | IAUKKGOVDOUWRW-UHFFFAOYSA-N |