5-bromo-3-methyl-N-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
5-bromo-3-methyl-N-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1-benzofuran-2-carboxamide
5-bromo-3-methyl-N-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | D519-0478 |
| Compound Name: | 5-bromo-3-methyl-N-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1-benzofuran-2-carboxamide |
| Molecular Weight: | 441.28 |
| Molecular Formula: | C21 H17 Br N2 O4 |
| Smiles: | [H]N(C(c1c(C)c2cc(ccc2o1)[Br])=O)c1ccc2c(c1)N(CC=C)C(CO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4258 |
| logD: | 4.4212 |
| logSw: | -4.4133 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.935 |
| InChI Key: | ZTCZZNRDISHVGF-UHFFFAOYSA-N |