(7S,8aS)-2-(3-fluoro-4-methoxybenzoyl)-7-methoxyhexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
Chemical Structure Depiction of
(7S,8aS)-2-(3-fluoro-4-methoxybenzoyl)-7-methoxyhexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
(7S,8aS)-2-(3-fluoro-4-methoxybenzoyl)-7-methoxyhexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
Compound characteristics
| Compound ID: | S915-0025 |
| Compound Name: | (7S,8aS)-2-(3-fluoro-4-methoxybenzoyl)-7-methoxyhexahydropyrrolo[1,2-a]pyrazin-4(1H)-one |
| Molecular Weight: | 322.33 |
| Molecular Formula: | C16 H19 F N2 O4 |
| Smiles: | COc1ccc(cc1F)C(N1CC(N2C[C@H](C[C@H]2C1)OC)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.3044 |
| logD: | 0.3044 |
| logSw: | -1.7471 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.43 |
| InChI Key: | AMHOIMBCKSMVJE-RYUDHWBXSA-N |