3-(2-methoxyphenyl)-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]propanamide
Chemical Structure Depiction of
3-(2-methoxyphenyl)-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]propanamide
3-(2-methoxyphenyl)-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]propanamide
Compound characteristics
| Compound ID: | P895-0328 |
| Compound Name: | 3-(2-methoxyphenyl)-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]propanamide |
| Molecular Weight: | 447.56 |
| Molecular Formula: | C25 H25 N3 O3 S |
| Smiles: | CC(C)N1C(c2cccnc2Sc2cc(ccc12)NC(CCc1ccccc1OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6072 |
| logD: | 4.6072 |
| logSw: | -4.3567 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.953 |
| InChI Key: | DEIRVJINFOTAAV-UHFFFAOYSA-N |