(5-chloro-2-methoxyphenyl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone
Chemical Structure Depiction of
(5-chloro-2-methoxyphenyl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone
(5-chloro-2-methoxyphenyl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone
Compound characteristics
| Compound ID: | S616-2129 |
| Compound Name: | (5-chloro-2-methoxyphenyl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone |
| Molecular Weight: | 358.84 |
| Molecular Formula: | C15 H19 Cl N2 O4 S |
| Smiles: | COc1ccc(cc1C(N1CC[C@@H]2CN([C@@H]2C1)S(C)(=O)=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4976 |
| logD: | 1.4976 |
| logSw: | -2.7757 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.985 |
| InChI Key: | CHHVZVLVZLHABQ-GWCFXTLKSA-N |