1-[2-oxo-3-(propan-2-yl)-2,3-dihydro-1,3-benzothiazole-6-sulfonyl]-N-[2-(pyrrolidin-1-yl)ethyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-[2-oxo-3-(propan-2-yl)-2,3-dihydro-1,3-benzothiazole-6-sulfonyl]-N-[2-(pyrrolidin-1-yl)ethyl]piperidine-4-carboxamide
1-[2-oxo-3-(propan-2-yl)-2,3-dihydro-1,3-benzothiazole-6-sulfonyl]-N-[2-(pyrrolidin-1-yl)ethyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | L306-1433 |
| Compound Name: | 1-[2-oxo-3-(propan-2-yl)-2,3-dihydro-1,3-benzothiazole-6-sulfonyl]-N-[2-(pyrrolidin-1-yl)ethyl]piperidine-4-carboxamide |
| Molecular Weight: | 480.65 |
| Molecular Formula: | C22 H32 N4 O4 S2 |
| Smiles: | CC(C)N1C(=O)Sc2cc(ccc12)S(N1CCC(CC1)C(NCCN1CCCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7236 |
| logD: | 0.4831 |
| logSw: | -3.3793 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.118 |
| InChI Key: | MXMWBDJQLHZXJN-UHFFFAOYSA-N |