9-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
9-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
9-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | SD68-0879 |
| Compound Name: | 9-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C23 H29 F N4 O3 |
| Smiles: | Cc1c(CCC(N2CCCN3CCN(Cc4ccc(cc4)F)C(C3C2)=O)=O)c(C)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4799 |
| logD: | 1.4749 |
| logSw: | -1.9414 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.247 |
| InChI Key: | XPJVHZGONRTAAS-NRFANRHFSA-N |