N-{2-[(pyridine-4-carbonyl)amino]ethyl}-1,3-benzothiazole-2-carboxamide
Chemical Structure Depiction of
N-{2-[(pyridine-4-carbonyl)amino]ethyl}-1,3-benzothiazole-2-carboxamide
N-{2-[(pyridine-4-carbonyl)amino]ethyl}-1,3-benzothiazole-2-carboxamide
Compound characteristics
| Compound ID: | IB05-4229 |
| Compound Name: | N-{2-[(pyridine-4-carbonyl)amino]ethyl}-1,3-benzothiazole-2-carboxamide |
| Molecular Weight: | 326.37 |
| Molecular Formula: | C16 H14 N4 O2 S |
| Smiles: | C(CNC(c1nc2ccccc2s1)=O)NC(c1ccncc1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.98 |
| logD: | 0.98 |
| logSw: | -2.09 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 114.2 |
| InChI Key: | UIRVDCQUTQXKAC-UHFFFAOYSA-N |