N-[rel-(1R,5S)-8-(4-ethylbenzene-1-sulfonyl)-8-azabicyclo[3.2.1]octan-3-yl]-4-fluorobenzamide
Chemical Structure Depiction of
N-[rel-(1R,5S)-8-(4-ethylbenzene-1-sulfonyl)-8-azabicyclo[3.2.1]octan-3-yl]-4-fluorobenzamide
N-[rel-(1R,5S)-8-(4-ethylbenzene-1-sulfonyl)-8-azabicyclo[3.2.1]octan-3-yl]-4-fluorobenzamide
Compound characteristics
| Compound ID: | T651-0070 |
| Compound Name: | N-[rel-(1R,5S)-8-(4-ethylbenzene-1-sulfonyl)-8-azabicyclo[3.2.1]octan-3-yl]-4-fluorobenzamide |
| Molecular Weight: | 416.51 |
| Molecular Formula: | C22 H25 F N2 O3 S |
| Smiles: | CCc1ccc(cc1)S(N1[C@H]2CC[C@@H]1CC(C2)NC(c1ccc(cc1)F)=O)(=O)=O |
| Stereo: | RELATIVE |
| logP: | 3.405 |
| logD: | 3.405 |
| logSw: | -3.7789 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.322 |
| InChI Key: | XVQSGIDTFJJDTR-IHWFROFDSA-N |