5-(benzylamino)-3-bromo-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-(benzylamino)-3-bromo-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-(benzylamino)-3-bromo-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0399 |
| Compound Name: | 5-(benzylamino)-3-bromo-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 405.25 |
| Molecular Formula: | C21 H13 Br N2 O2 |
| Smiles: | C(c1ccccc1)Nc1cc(c2c3c1C(c1ccccc1c3on2)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.3232 |
| logD: | 5.3232 |
| logSw: | -5.827 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.717 |
| InChI Key: | GXEABOCBCATMTN-UHFFFAOYSA-N |