N-[(4-ethoxyphenyl)methyl]-1-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(4-ethoxyphenyl)methyl]-1-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)piperidine-4-carboxamide
N-[(4-ethoxyphenyl)methyl]-1-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E977-0615 |
| Compound Name: | N-[(4-ethoxyphenyl)methyl]-1-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 485.6 |
| Molecular Formula: | C25 H31 N3 O5 S |
| Smiles: | CCOc1ccc(CNC(C2CCN(CC2)S(c2ccc3c(CCCC(N3)=O)c2)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.1917 |
| logD: | 2.1917 |
| logSw: | -2.8845 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.638 |
| InChI Key: | PYDANUPBXKFNND-UHFFFAOYSA-N |