8-(butane-1-sulfonyl)-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
8-(butane-1-sulfonyl)-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
8-(butane-1-sulfonyl)-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0457 |
| Compound Name: | 8-(butane-1-sulfonyl)-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 411.49 |
| Molecular Formula: | C19 H26 F N3 O4 S |
| Smiles: | CCCCS(N1CCC2C(N(CC(N2CC1)=O)Cc1cccc(c1)F)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3009 |
| logD: | 1.3009 |
| logSw: | -2.2672 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.319 |
| InChI Key: | NWLHMRJEWLHZSN-QGZVFWFLSA-N |