3-{2-oxo-2-[8-(5-propyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]ethyl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-{2-oxo-2-[8-(5-propyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]ethyl}-1,3-benzoxazol-2(3H)-one
3-{2-oxo-2-[8-(5-propyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]ethyl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | SC70-0461 |
| Compound Name: | 3-{2-oxo-2-[8-(5-propyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]ethyl}-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 395.46 |
| Molecular Formula: | C21 H25 N5 O3 |
| Smiles: | CCCc1nc(C2CN(CC23CCC3)C(CN2C(=O)Oc3ccccc23)=O)n[nH]1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4453 |
| logD: | 2.4427 |
| logSw: | -2.7729 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.719 |
| InChI Key: | YBCKXECAHZBUQV-AWEZNQCLSA-N |