2-(3-fluorophenyl)-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]acetamide
Chemical Structure Depiction of
2-(3-fluorophenyl)-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]acetamide
2-(3-fluorophenyl)-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]acetamide
Compound characteristics
| Compound ID: | P895-0296 |
| Compound Name: | 2-(3-fluorophenyl)-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]acetamide |
| Molecular Weight: | 421.49 |
| Molecular Formula: | C23 H20 F N3 O2 S |
| Smiles: | CC(C)N1C(c2cccnc2Sc2cc(ccc12)NC(Cc1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2997 |
| logD: | 4.2997 |
| logSw: | -4.3554 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.323 |
| InChI Key: | YUBLVOBXKVTXDW-UHFFFAOYSA-N |