rel-(1R,5S)-3-benzyl-7-(4-fluorobenzene-1-sulfonyl)-3,7,9-triazabicyclo[3.3.2]decan-10-one
Chemical Structure Depiction of
rel-(1R,5S)-3-benzyl-7-(4-fluorobenzene-1-sulfonyl)-3,7,9-triazabicyclo[3.3.2]decan-10-one
rel-(1R,5S)-3-benzyl-7-(4-fluorobenzene-1-sulfonyl)-3,7,9-triazabicyclo[3.3.2]decan-10-one
Compound characteristics
| Compound ID: | SD24-0205 |
| Compound Name: | rel-(1R,5S)-3-benzyl-7-(4-fluorobenzene-1-sulfonyl)-3,7,9-triazabicyclo[3.3.2]decan-10-one |
| Molecular Weight: | 403.47 |
| Molecular Formula: | C20 H22 F N3 O3 S |
| Smiles: | [H][C@]12CN(Cc3ccccc3)C[C@]([H])(CN(C1)S(c1ccc(cc1)F)(=O)=O)C(N2)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.8527 |
| logD: | 1.4999 |
| logSw: | -2.4999 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.215 |
| InChI Key: | OSZPXHFBXWKWLJ-AEFFLSMTSA-N |