2,2-dimethyl-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]propanamide
Chemical Structure Depiction of
2,2-dimethyl-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]propanamide
2,2-dimethyl-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]propanamide
Compound characteristics
| Compound ID: | P895-0326 |
| Compound Name: | 2,2-dimethyl-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]propanamide |
| Molecular Weight: | 369.48 |
| Molecular Formula: | C20 H23 N3 O2 S |
| Smiles: | CC(C)N1C(c2cccnc2Sc2cc(ccc12)NC(C(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8342 |
| logD: | 3.8342 |
| logSw: | -4.0361 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.808 |
| InChI Key: | OXHOXULKSRLSAQ-UHFFFAOYSA-N |