N-[3-(4-ethylpiperazin-1-yl)-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl]glycine
Chemical Structure Depiction of
N-[3-(4-ethylpiperazin-1-yl)-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl]glycine
N-[3-(4-ethylpiperazin-1-yl)-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl]glycine
Compound characteristics
| Compound ID: | C090-0581 |
| Compound Name: | N-[3-(4-ethylpiperazin-1-yl)-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl]glycine |
| Molecular Weight: | 406.44 |
| Molecular Formula: | C22 H22 N4 O4 |
| Smiles: | CCN1CCN(CC1)c1cc(c2C(c3ccccc3c3c2c1no3)=O)NCC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.547 |
| logD: | 2.547 |
| logSw: | -2.9744 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.061 |
| InChI Key: | RRSMVAZHEVQJRG-UHFFFAOYSA-N |