2-[(3-fluorophenyl)methyl]-8-[4-(methoxymethyl)-5-methyl-1,2-oxazole-3-carbonyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
2-[(3-fluorophenyl)methyl]-8-[4-(methoxymethyl)-5-methyl-1,2-oxazole-3-carbonyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
2-[(3-fluorophenyl)methyl]-8-[4-(methoxymethyl)-5-methyl-1,2-oxazole-3-carbonyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0491 |
| Compound Name: | 2-[(3-fluorophenyl)methyl]-8-[4-(methoxymethyl)-5-methyl-1,2-oxazole-3-carbonyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 444.46 |
| Molecular Formula: | C22 H25 F N4 O5 |
| Smiles: | Cc1c(COC)c(C(N2CCC3C(N(CC(N3CC2)=O)Cc2cccc(c2)F)=O)=O)no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5335 |
| logD: | 0.5335 |
| logSw: | -1.5517 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.746 |
| InChI Key: | XXLKFKWLXYEDFD-SFHVURJKSA-N |