(3S,7S,8aS)-2-[(5-bromofuran-2-yl)methyl]-7-(dimethylamino)-3-methylhexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
Chemical Structure Depiction of
(3S,7S,8aS)-2-[(5-bromofuran-2-yl)methyl]-7-(dimethylamino)-3-methylhexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
(3S,7S,8aS)-2-[(5-bromofuran-2-yl)methyl]-7-(dimethylamino)-3-methylhexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
Compound characteristics
| Compound ID: | S974-2283 |
| Compound Name: | (3S,7S,8aS)-2-[(5-bromofuran-2-yl)methyl]-7-(dimethylamino)-3-methylhexahydropyrrolo[1,2-a]pyrazin-4(1H)-one |
| Molecular Weight: | 356.26 |
| Molecular Formula: | C15 H22 Br N3 O2 |
| Smiles: | C[C@H]1C(N2C[C@H](C[C@H]2CN1Cc1ccc(o1)[Br])N(C)C)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.2429 |
| logD: | -0.4692 |
| logSw: | -1.9903 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 30.4313 |
| InChI Key: | QZMKTBCIEGMOPG-QJPTWQEYSA-N |