8-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
8-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
8-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0468 |
| Compound Name: | 8-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 441.5 |
| Molecular Formula: | C23 H28 F N5 O3 |
| Smiles: | Cc1cc(C)n(CCC(N2CCC3C(N(CC(N3CC2)=O)Cc2cccc(c2)F)=O)=O)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.0608 |
| logD: | 0.0605 |
| logSw: | -1.4563 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 63.548 |
| InChI Key: | WEEQXOBPXYAZSF-FQEVSTJZSA-N |