6-bromo-4,4-diethyl-2-(5-nitrofuran-2-yl)-4H-3,1-benzoxazine
Chemical Structure Depiction of
6-bromo-4,4-diethyl-2-(5-nitrofuran-2-yl)-4H-3,1-benzoxazine
6-bromo-4,4-diethyl-2-(5-nitrofuran-2-yl)-4H-3,1-benzoxazine
Compound characteristics
| Compound ID: | 8013-0888 |
| Compound Name: | 6-bromo-4,4-diethyl-2-(5-nitrofuran-2-yl)-4H-3,1-benzoxazine |
| Molecular Weight: | 379.21 |
| Molecular Formula: | C16 H15 Br N2 O4 |
| Smiles: | CCC1(CC)c2cc(ccc2N=C(c2ccc([N+]([O-])=O)o2)O1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.4668 |
| logD: | 4.4668 |
| logSw: | -4.4979 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.262 |
| InChI Key: | HKKGQXXARJXJBT-UHFFFAOYSA-N |