rel-(1R,5S)-3-ethyl-7-(3-methylbenzoyl)-3,7,9-triazabicyclo[3.3.2]decan-10-one
Chemical Structure Depiction of
rel-(1R,5S)-3-ethyl-7-(3-methylbenzoyl)-3,7,9-triazabicyclo[3.3.2]decan-10-one
rel-(1R,5S)-3-ethyl-7-(3-methylbenzoyl)-3,7,9-triazabicyclo[3.3.2]decan-10-one
Compound characteristics
| Compound ID: | SD24-0023 |
| Compound Name: | rel-(1R,5S)-3-ethyl-7-(3-methylbenzoyl)-3,7,9-triazabicyclo[3.3.2]decan-10-one |
| Molecular Weight: | 301.39 |
| Molecular Formula: | C17 H23 N3 O2 |
| Smiles: | [H][C@]12CN(CC)C[C@]([H])(CN(C1)C(c1cccc(C)c1)=O)C(N2)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.6961 |
| logD: | -1.7275 |
| logSw: | -1.958 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.148 |
| InChI Key: | GTEBOUBXQICJAU-CABCVRRESA-N |