9-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
9-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
9-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | SD68-0761 |
| Compound Name: | 9-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 410.52 |
| Molecular Formula: | C23 H30 N4 O3 |
| Smiles: | Cc1cccc(CN2CCN3CCCN(CC3C2=O)C(Cc2c(C)noc2C)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.989 |
| logD: | 1.9832 |
| logSw: | -2.2093 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.247 |
| InChI Key: | LBRAYQNFYYTRJK-NRFANRHFSA-N |