3-{2-[(3S,7S,8aS)-7-(dimethylamino)-3-methyl-4-oxohexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-{2-[(3S,7S,8aS)-7-(dimethylamino)-3-methyl-4-oxohexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
3-{2-[(3S,7S,8aS)-7-(dimethylamino)-3-methyl-4-oxohexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | S974-0462 |
| Compound Name: | 3-{2-[(3S,7S,8aS)-7-(dimethylamino)-3-methyl-4-oxohexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 372.42 |
| Molecular Formula: | C19 H24 N4 O4 |
| Smiles: | C[C@H]1C(N2C[C@H](C[C@H]2CN1C(CN1C(=O)Oc2ccccc12)=O)N(C)C)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.2036 |
| logD: | -1.5011 |
| logSw: | -1.6135 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.658 |
| InChI Key: | ZFWUZXKZAKHSQL-MJBXVCDLSA-N |