rel-(3aR,6aS)-2-(3-methoxypropyl)-5-(prop-2-ynoyl)tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
Chemical Structure Depiction of
rel-(3aR,6aS)-2-(3-methoxypropyl)-5-(prop-2-ynoyl)tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
rel-(3aR,6aS)-2-(3-methoxypropyl)-5-(prop-2-ynoyl)tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
Compound characteristics
Compound ID: | T001-0601 |
Compound Name: | rel-(3aR,6aS)-2-(3-methoxypropyl)-5-(prop-2-ynoyl)tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione |
Molecular Weight: | 264.28 |
Molecular Formula: | C13 H16 N2 O4 |
Smiles: | COCCCN1C([C@@H]2CN(C[C@@H]2C1=O)C(C#C)=O)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | -0.8924 |
logD: | -0.8924 |
logSw: | -0.6969 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 54.709 |
InChI Key: | GSYPAJUEGGZJKV-UWVGGRQHSA-N |