6-bromo-2-[4-(hexyloxy)phenyl]-4H-3,1-benzoxazin-4-one
Chemical Structure Depiction of
6-bromo-2-[4-(hexyloxy)phenyl]-4H-3,1-benzoxazin-4-one
6-bromo-2-[4-(hexyloxy)phenyl]-4H-3,1-benzoxazin-4-one
Compound characteristics
| Compound ID: | 0938-8027 |
| Compound Name: | 6-bromo-2-[4-(hexyloxy)phenyl]-4H-3,1-benzoxazin-4-one |
| Molecular Weight: | 402.29 |
| Molecular Formula: | C20 H20 Br N O3 |
| Smiles: | CCCCCCOc1ccc(cc1)C1=Nc2ccc(cc2C(=O)O1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.011 |
| logD: | 6.011 |
| logSw: | -5.3692 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.603 |
| InChI Key: | GZHYQTABJNCBMG-UHFFFAOYSA-N |