2-[(3-fluorophenyl)methyl]-8-(1-methyl-1H-pyrrole-2-carbonyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
2-[(3-fluorophenyl)methyl]-8-(1-methyl-1H-pyrrole-2-carbonyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
2-[(3-fluorophenyl)methyl]-8-(1-methyl-1H-pyrrole-2-carbonyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0462 |
| Compound Name: | 2-[(3-fluorophenyl)methyl]-8-(1-methyl-1H-pyrrole-2-carbonyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 398.44 |
| Molecular Formula: | C21 H23 F N4 O3 |
| Smiles: | Cn1cccc1C(N1CCC2C(N(CC(N2CC1)=O)Cc1cccc(c1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5236 |
| logD: | 1.5236 |
| logSw: | -1.7681 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.507 |
| InChI Key: | HLKWWFJJQORTQL-SFHVURJKSA-N |