N-[3-(morpholin-4-yl)-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl]-beta-alanine
Chemical Structure Depiction of
N-[3-(morpholin-4-yl)-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl]-beta-alanine
N-[3-(morpholin-4-yl)-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl]-beta-alanine
Compound characteristics
| Compound ID: | 8015-7306 |
| Compound Name: | N-[3-(morpholin-4-yl)-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl]-beta-alanine |
| Molecular Weight: | 393.4 |
| Molecular Formula: | C21 H19 N3 O5 |
| Smiles: | C(CNc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCOCC1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5675 |
| logD: | -0.1024 |
| logSw: | -3.2701 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.274 |
| InChI Key: | YKJZIYZDQFBULM-UHFFFAOYSA-N |