(1H-indol-4-yl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone
Chemical Structure Depiction of
(1H-indol-4-yl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone
(1H-indol-4-yl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone
Compound characteristics
| Compound ID: | S616-2314 |
| Compound Name: | (1H-indol-4-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(c1cccc2c1cc[nH]2)=O)(=O)=O |
| Stereo: | RELATIVE |
| logP: | 0.9772 |
| logD: | 0.9772 |
| logSw: | -2.302 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.136 |
| InChI Key: | LIGAMNRBYVQHID-ABAIWWIYSA-N |