(2-chloro-4-fluorophenyl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone
Chemical Structure Depiction of
(2-chloro-4-fluorophenyl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone
(2-chloro-4-fluorophenyl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone
Compound characteristics
| Compound ID: | S616-1309 |
| Compound Name: | (2-chloro-4-fluorophenyl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone |
| Molecular Weight: | 346.81 |
| Molecular Formula: | C14 H16 Cl F N2 O3 S |
| Smiles: | CS(N1C[C@H]2CCN(C[C@@H]12)C(c1ccc(cc1[Cl])F)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4681 |
| logD: | 1.4681 |
| logSw: | -2.9792 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.354 |
| InChI Key: | MQDHVTBNSOZSKL-ZANVPECISA-N |