(3S,7S,8aS)-3-benzyl-7-methoxy-4-oxo-N-(2-phenylethyl)hexahydropyrrolo[1,2-a]pyrazine-2(1H)-carboxamide
Chemical Structure Depiction of
(3S,7S,8aS)-3-benzyl-7-methoxy-4-oxo-N-(2-phenylethyl)hexahydropyrrolo[1,2-a]pyrazine-2(1H)-carboxamide
(3S,7S,8aS)-3-benzyl-7-methoxy-4-oxo-N-(2-phenylethyl)hexahydropyrrolo[1,2-a]pyrazine-2(1H)-carboxamide
Compound characteristics
| Compound ID: | S915-0312 |
| Compound Name: | (3S,7S,8aS)-3-benzyl-7-methoxy-4-oxo-N-(2-phenylethyl)hexahydropyrrolo[1,2-a]pyrazine-2(1H)-carboxamide |
| Molecular Weight: | 407.51 |
| Molecular Formula: | C24 H29 N3 O3 |
| Smiles: | CO[C@H]1C[C@H]2CN(C(NCCc3ccccc3)=O)[C@@H](Cc3ccccc3)C(N2C1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.969 |
| logD: | 2.969 |
| logSw: | -3.3096 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.771 |
| InChI Key: | BPHGDYPYGUQTNR-BDTNDASRSA-N |