(3S,7S,8aS)-3-benzyl-N,N-diethyl-7-methoxy-4-oxohexahydropyrrolo[1,2-a]pyrazine-2(1H)-carboxamide
Chemical Structure Depiction of
(3S,7S,8aS)-3-benzyl-N,N-diethyl-7-methoxy-4-oxohexahydropyrrolo[1,2-a]pyrazine-2(1H)-carboxamide
(3S,7S,8aS)-3-benzyl-N,N-diethyl-7-methoxy-4-oxohexahydropyrrolo[1,2-a]pyrazine-2(1H)-carboxamide
Compound characteristics
| Compound ID: | S915-0284 |
| Compound Name: | (3S,7S,8aS)-3-benzyl-N,N-diethyl-7-methoxy-4-oxohexahydropyrrolo[1,2-a]pyrazine-2(1H)-carboxamide |
| Molecular Weight: | 359.47 |
| Molecular Formula: | C20 H29 N3 O3 |
| Smiles: | CCN(CC)C(N1C[C@@H]2C[C@@H](CN2C([C@@H]1Cc1ccccc1)=O)OC)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.3916 |
| logD: | 2.3916 |
| logSw: | -2.5214 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.876 |
| InChI Key: | BJECQEQFELKFIU-KSZLIROESA-N |