N-(2,5-difluorophenyl)-4-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)butanamide
Chemical Structure Depiction of
N-(2,5-difluorophenyl)-4-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)butanamide
N-(2,5-difluorophenyl)-4-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)butanamide
Compound characteristics
| Compound ID: | G290-1162 |
| Compound Name: | N-(2,5-difluorophenyl)-4-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)butanamide |
| Molecular Weight: | 425.46 |
| Molecular Formula: | C22 H17 F2 N3 O2 S |
| Smiles: | C(CC(Nc1cc(ccc1F)F)=O)CN1C(c2cccnc2Sc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6763 |
| logD: | 3.6577 |
| logSw: | -4.0431 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.883 |
| InChI Key: | KAXKMGAHXVWQFD-UHFFFAOYSA-N |