N-(2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)furan-2-carboxamide
Chemical Structure Depiction of
N-(2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)furan-2-carboxamide
N-(2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)furan-2-carboxamide
Compound characteristics
| Compound ID: | D336-0220 |
| Compound Name: | N-(2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)furan-2-carboxamide |
| Molecular Weight: | 387.48 |
| Molecular Formula: | C18 H17 N3 O3 S2 |
| Smiles: | C1CCN(C1)C(CSc1nc2ccc(cc2s1)NC(c1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.456 |
| logD: | 3.4558 |
| logSw: | -3.7551 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.476 |
| InChI Key: | XCBFBQLRUSAVPF-UHFFFAOYSA-N |