N-(4-cyano-1-oxo-1H-pyrido[2,1-b][1,3]benzothiazol-2-yl)-4-fluorobenzamide
Chemical Structure Depiction of
N-(4-cyano-1-oxo-1H-pyrido[2,1-b][1,3]benzothiazol-2-yl)-4-fluorobenzamide
N-(4-cyano-1-oxo-1H-pyrido[2,1-b][1,3]benzothiazol-2-yl)-4-fluorobenzamide
Compound characteristics
| Compound ID: | 7541-0106 |
| Compound Name: | N-(4-cyano-1-oxo-1H-pyrido[2,1-b][1,3]benzothiazol-2-yl)-4-fluorobenzamide |
| Molecular Weight: | 363.37 |
| Molecular Formula: | C19 H10 F N3 O2 S |
| Smiles: | C1=C(C(N2C(=C1C#N)Sc1ccccc12)=O)NC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6971 |
| logD: | 1.0615 |
| logSw: | -3.4376 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.875 |
| InChI Key: | HTMSQXFYTAYIRT-UHFFFAOYSA-N |