5-[benzyl(methyl)amino]-3-bromo-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-[benzyl(methyl)amino]-3-bromo-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-[benzyl(methyl)amino]-3-bromo-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0811 |
| Compound Name: | 5-[benzyl(methyl)amino]-3-bromo-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 419.28 |
| Molecular Formula: | C22 H15 Br N2 O2 |
| Smiles: | CN(Cc1ccccc1)c1cc(c2c3c1C(c1ccccc1c3on2)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.791 |
| logD: | 5.791 |
| logSw: | -5.8771 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.834 |
| InChI Key: | UUOPODMAPVAGGW-UHFFFAOYSA-N |