3-fluoro-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]benzamide
Chemical Structure Depiction of
3-fluoro-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]benzamide
3-fluoro-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]benzamide
Compound characteristics
| Compound ID: | P895-0294 |
| Compound Name: | 3-fluoro-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]benzamide |
| Molecular Weight: | 407.47 |
| Molecular Formula: | C22 H18 F N3 O2 S |
| Smiles: | CC(C)N1C(c2cccnc2Sc2cc(ccc12)NC(c1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3659 |
| logD: | 4.3658 |
| logSw: | -4.4045 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.536 |
| InChI Key: | GBEQSQOIFHHBQD-UHFFFAOYSA-N |