(3S,7S,8aS)-7-(dimethylamino)-2-[(3-fluoropyridin-4-yl)methyl]-3-methylhexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
Chemical Structure Depiction of
(3S,7S,8aS)-7-(dimethylamino)-2-[(3-fluoropyridin-4-yl)methyl]-3-methylhexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
(3S,7S,8aS)-7-(dimethylamino)-2-[(3-fluoropyridin-4-yl)methyl]-3-methylhexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
Compound characteristics
| Compound ID: | S974-2247 |
| Compound Name: | (3S,7S,8aS)-7-(dimethylamino)-2-[(3-fluoropyridin-4-yl)methyl]-3-methylhexahydropyrrolo[1,2-a]pyrazin-4(1H)-one |
| Molecular Weight: | 306.38 |
| Molecular Formula: | C16 H23 F N4 O |
| Smiles: | C[C@H]1C(N2C[C@H](C[C@H]2CN1Cc1ccncc1F)N(C)C)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.4516 |
| logD: | -1.2606 |
| logSw: | -0.8911 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 31.853 |
| InChI Key: | LZPSIZOUVGBMAT-IACUBPJLSA-N |