4-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5(6H)-yl)-N-(propan-2-yl)butanamide
Chemical Structure Depiction of
4-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5(6H)-yl)-N-(propan-2-yl)butanamide
4-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5(6H)-yl)-N-(propan-2-yl)butanamide
Compound characteristics
| Compound ID: | E523-0688 |
| Compound Name: | 4-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5(6H)-yl)-N-(propan-2-yl)butanamide |
| Molecular Weight: | 355.46 |
| Molecular Formula: | C19 H21 N3 O2 S |
| Smiles: | CC(C)NC(CCCN1C(c2ccccc2Sc2c1cccn2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1517 |
| logD: | 2.1517 |
| logSw: | -2.8221 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.149 |
| InChI Key: | FNIFVZISWREUPP-UHFFFAOYSA-N |