8-(4-fluorobenzene-1-sulfonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
8-(4-fluorobenzene-1-sulfonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
8-(4-fluorobenzene-1-sulfonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0805 |
| Compound Name: | 8-(4-fluorobenzene-1-sulfonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 445.51 |
| Molecular Formula: | C22 H24 F N3 O4 S |
| Smiles: | Cc1cccc(CN2CC(N3CCN(CCC3C2=O)S(c2ccc(cc2)F)(=O)=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3192 |
| logD: | 2.3192 |
| logSw: | -2.6961 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.153 |
| InChI Key: | NUZUOSANKVVXOQ-HXUWFJFHSA-N |