6-bromo-4-oxo-N-[2-(piperidin-1-yl)-2-(thiophen-2-yl)ethyl]-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
6-bromo-4-oxo-N-[2-(piperidin-1-yl)-2-(thiophen-2-yl)ethyl]-4H-1-benzopyran-2-carboxamide
6-bromo-4-oxo-N-[2-(piperidin-1-yl)-2-(thiophen-2-yl)ethyl]-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D491-2314 |
| Compound Name: | 6-bromo-4-oxo-N-[2-(piperidin-1-yl)-2-(thiophen-2-yl)ethyl]-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 461.38 |
| Molecular Formula: | C21 H21 Br N2 O3 S |
| Smiles: | [H]N(CC(c1cccs1)N1CCCCC1)C(C1=CC(c2cc(ccc2O1)[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0883 |
| logD: | 3.6929 |
| logSw: | -4.1665 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.478 |
| InChI Key: | WEVYTFVLQUWYJY-INIZCTEOSA-N |