(3S,7S,8aS)-7-(dimethylamino)-2-[3-(4-methoxyphenyl)propanoyl]-3-methylhexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
Chemical Structure Depiction of
(3S,7S,8aS)-7-(dimethylamino)-2-[3-(4-methoxyphenyl)propanoyl]-3-methylhexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
(3S,7S,8aS)-7-(dimethylamino)-2-[3-(4-methoxyphenyl)propanoyl]-3-methylhexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
Compound characteristics
| Compound ID: | S974-0428 |
| Compound Name: | (3S,7S,8aS)-7-(dimethylamino)-2-[3-(4-methoxyphenyl)propanoyl]-3-methylhexahydropyrrolo[1,2-a]pyrazin-4(1H)-one |
| Molecular Weight: | 359.47 |
| Molecular Formula: | C20 H29 N3 O3 |
| Smiles: | C[C@H]1C(N2C[C@H](C[C@H]2CN1C(CCc1ccc(cc1)OC)=O)N(C)C)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.4092 |
| logD: | -0.2955 |
| logSw: | -1.8058 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.101 |
| InChI Key: | CJQHJBBZVWHSBG-XIRDDKMYSA-N |