2-[(7-bromo-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]-N,N-diethylacetamide
Chemical Structure Depiction of
2-[(7-bromo-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]-N,N-diethylacetamide
2-[(7-bromo-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]-N,N-diethylacetamide
Compound characteristics
| Compound ID: | C683-0185 |
| Compound Name: | 2-[(7-bromo-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]-N,N-diethylacetamide |
| Molecular Weight: | 484.41 |
| Molecular Formula: | C23 H22 Br N3 O2 S |
| Smiles: | CCN(CC)C(CSc1c2Cc3cc(ccc3Oc2nc(c2ccccc2)n1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.3554 |
| logD: | 6.348 |
| logSw: | -5.6079 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.807 |
| InChI Key: | FZQOYDRRURTFDS-UHFFFAOYSA-N |