8-(1,2-dimethyl-1H-imidazole-4-sulfonyl)-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
8-(1,2-dimethyl-1H-imidazole-4-sulfonyl)-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
8-(1,2-dimethyl-1H-imidazole-4-sulfonyl)-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0401 |
| Compound Name: | 8-(1,2-dimethyl-1H-imidazole-4-sulfonyl)-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 449.5 |
| Molecular Formula: | C20 H24 F N5 O4 S |
| Smiles: | Cc1nc(cn1C)S(N1CCC2C(N(CC(N2CC1)=O)Cc1cccc(c1)F)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.2251 |
| logD: | 0.2251 |
| logSw: | -2.1219 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.503 |
| InChI Key: | FZLDINUKTRUGBG-QGZVFWFLSA-N |