6-bromo-N-{2-(morpholin-4-yl)-2-[4-(propan-2-yl)phenyl]ethyl}-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
6-bromo-N-{2-(morpholin-4-yl)-2-[4-(propan-2-yl)phenyl]ethyl}-4-oxo-4H-1-benzopyran-2-carboxamide
6-bromo-N-{2-(morpholin-4-yl)-2-[4-(propan-2-yl)phenyl]ethyl}-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D491-2328 |
| Compound Name: | 6-bromo-N-{2-(morpholin-4-yl)-2-[4-(propan-2-yl)phenyl]ethyl}-4-oxo-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 499.4 |
| Molecular Formula: | C25 H27 Br N2 O4 |
| Smiles: | [H]N(CC(c1ccc(cc1)C(C)C)N1CCOCC1)C(C1=CC(c2cc(ccc2O1)[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7804 |
| logD: | 4.7677 |
| logSw: | -4.4661 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.368 |
| InChI Key: | VNDXHVURJPAQOL-NRFANRHFSA-N |