6-ethyl-5-oxo-N-[(oxolan-2-yl)methyl]-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Chemical Structure Depiction of
6-ethyl-5-oxo-N-[(oxolan-2-yl)methyl]-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
6-ethyl-5-oxo-N-[(oxolan-2-yl)methyl]-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Compound characteristics
| Compound ID: | P617-0378 |
| Compound Name: | 6-ethyl-5-oxo-N-[(oxolan-2-yl)methyl]-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide |
| Molecular Weight: | 383.47 |
| Molecular Formula: | C20 H21 N3 O3 S |
| Smiles: | CCN1C(c2cccnc2Sc2cc(ccc12)C(NCC1CCCO1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1646 |
| logD: | 2.1646 |
| logSw: | -2.902 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.517 |
| InChI Key: | BHKVMWFMKHJVBH-CQSZACIVSA-N |