4-(1,2-benzothiazol-3-yl)-N-(2-oxo-2-{[(pyridin-3-yl)methyl]amino}ethyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-(1,2-benzothiazol-3-yl)-N-(2-oxo-2-{[(pyridin-3-yl)methyl]amino}ethyl)piperazine-1-carboxamide
4-(1,2-benzothiazol-3-yl)-N-(2-oxo-2-{[(pyridin-3-yl)methyl]amino}ethyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | Y043-6539 |
| Compound Name: | 4-(1,2-benzothiazol-3-yl)-N-(2-oxo-2-{[(pyridin-3-yl)methyl]amino}ethyl)piperazine-1-carboxamide |
| Molecular Weight: | 410.5 |
| Molecular Formula: | C20 H22 N6 O2 S |
| Smiles: | C(C(NCc1cccnc1)=O)NC(N1CCN(CC1)c1c2ccccc2sn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2412 |
| logD: | 2.2388 |
| logSw: | -2.3048 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.432 |
| InChI Key: | STWJKKQVSLFBPG-UHFFFAOYSA-N |