2-[(4-fluorophenyl)methyl]-8-[3-(4-methoxyphenyl)propanoyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
2-[(4-fluorophenyl)methyl]-8-[3-(4-methoxyphenyl)propanoyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
2-[(4-fluorophenyl)methyl]-8-[3-(4-methoxyphenyl)propanoyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0838 |
| Compound Name: | 2-[(4-fluorophenyl)methyl]-8-[3-(4-methoxyphenyl)propanoyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 439.53 |
| Molecular Formula: | C25 H30 F N3 O3 |
| Smiles: | COc1ccc(CCC(N2CCC3C(N(CCN3CC2)Cc2ccc(cc2)F)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5242 |
| logD: | 2.5192 |
| logSw: | -2.3629 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.819 |
| InChI Key: | PMJQWTWTCJUTNY-QHCPKHFHSA-N |