2-[(3-methylphenyl)methyl]-8-(pyrimidine-4-carbonyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
2-[(3-methylphenyl)methyl]-8-(pyrimidine-4-carbonyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
2-[(3-methylphenyl)methyl]-8-(pyrimidine-4-carbonyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0844 |
| Compound Name: | 2-[(3-methylphenyl)methyl]-8-(pyrimidine-4-carbonyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 393.44 |
| Molecular Formula: | C21 H23 N5 O3 |
| Smiles: | Cc1cccc(CN2CC(N3CCN(CCC3C2=O)C(c2ccncn2)=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4762 |
| logD: | 0.4761 |
| logSw: | -1.1773 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.281 |
| InChI Key: | QMBZIRGLLABEBA-SFHVURJKSA-N |