N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]-1-phenylcyclopropane-1-carboxamide
Chemical Structure Depiction of
N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]-1-phenylcyclopropane-1-carboxamide
N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]-1-phenylcyclopropane-1-carboxamide
Compound characteristics
| Compound ID: | P895-0332 |
| Compound Name: | N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]-1-phenylcyclopropane-1-carboxamide |
| Molecular Weight: | 429.54 |
| Molecular Formula: | C25 H23 N3 O2 S |
| Smiles: | CC(C)N1C(c2cccnc2Sc2cc(ccc12)NC(C1(CC1)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6058 |
| logD: | 4.6058 |
| logSw: | -4.3669 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.788 |
| InChI Key: | ZHJAUHZTDNXYRG-UHFFFAOYSA-N |