5-chloro-2-fluoro-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]benzamide
Chemical Structure Depiction of
5-chloro-2-fluoro-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]benzamide
5-chloro-2-fluoro-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]benzamide
Compound characteristics
| Compound ID: | P895-0302 |
| Compound Name: | 5-chloro-2-fluoro-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]benzamide |
| Molecular Weight: | 441.91 |
| Molecular Formula: | C22 H17 Cl F N3 O2 S |
| Smiles: | CC(C)N1C(c2cccnc2Sc2cc(ccc12)NC(c1cc(ccc1F)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0319 |
| logD: | 5.0306 |
| logSw: | -5.0429 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.536 |
| InChI Key: | AUFIGTWQAYJYCS-UHFFFAOYSA-N |