8-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
8-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
8-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0890 |
| Compound Name: | 8-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 414.48 |
| Molecular Formula: | C22 H27 F N4 O3 |
| Smiles: | Cc1c(CC(N2CCC3C(N(CCN3CC2)Cc2ccc(cc2)F)=O)=O)c(C)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3419 |
| logD: | 1.3361 |
| logSw: | -1.9107 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.313 |
| InChI Key: | WMLJNLCDMUZQLR-FQEVSTJZSA-N |