rel-(1R,5S)-3-ethyl-7-(5-methyl-1,2-oxazole-3-carbonyl)-3,7,9-triazabicyclo[3.3.2]decan-10-one
Chemical Structure Depiction of
rel-(1R,5S)-3-ethyl-7-(5-methyl-1,2-oxazole-3-carbonyl)-3,7,9-triazabicyclo[3.3.2]decan-10-one
rel-(1R,5S)-3-ethyl-7-(5-methyl-1,2-oxazole-3-carbonyl)-3,7,9-triazabicyclo[3.3.2]decan-10-one
Compound characteristics
| Compound ID: | SD24-0015 |
| Compound Name: | rel-(1R,5S)-3-ethyl-7-(5-methyl-1,2-oxazole-3-carbonyl)-3,7,9-triazabicyclo[3.3.2]decan-10-one |
| Molecular Weight: | 292.34 |
| Molecular Formula: | C14 H20 N4 O3 |
| Smiles: | [H][C@]12CN(CC)C[C@]([H])(CN(C1)C(c1cc(C)on1)=O)C(N2)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.0228 |
| logD: | -2.4463 |
| logSw: | -1.2819 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.377 |
| InChI Key: | NCKISFYRUVZNBX-MNOVXSKESA-N |