(1H-indol-6-yl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone
Chemical Structure Depiction of
(1H-indol-6-yl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone
(1H-indol-6-yl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone
Compound characteristics
| Compound ID: | S616-2305 |
| Compound Name: | (1H-indol-6-yl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone |
| Molecular Weight: | 333.41 |
| Molecular Formula: | C16 H19 N3 O3 S |
| Smiles: | CS(N1C[C@H]2CCN(C[C@@H]12)C(c1ccc2cc[nH]c2c1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.1526 |
| logD: | 1.1526 |
| logSw: | -2.6029 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.136 |
| InChI Key: | YYKYAQOJANUWJE-HIFRSBDPSA-N |