N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-6-methoxypyridine-3-carboxamide
Chemical Structure Depiction of
N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-6-methoxypyridine-3-carboxamide
N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-6-methoxypyridine-3-carboxamide
Compound characteristics
| Compound ID: | P895-0214 |
| Compound Name: | N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-6-methoxypyridine-3-carboxamide |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C21 H18 N4 O3 S |
| Smiles: | CCN1C(c2cccnc2Sc2cc(ccc12)NC(c1ccc(nc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5652 |
| logD: | 3.5651 |
| logSw: | -3.6662 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.122 |
| InChI Key: | MBONGUFMWPEFPA-UHFFFAOYSA-N |