8-[3-(2-methoxyphenyl)propanoyl]-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
8-[3-(2-methoxyphenyl)propanoyl]-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
8-[3-(2-methoxyphenyl)propanoyl]-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0480 |
| Compound Name: | 8-[3-(2-methoxyphenyl)propanoyl]-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 435.57 |
| Molecular Formula: | C26 H33 N3 O3 |
| Smiles: | Cc1cccc(CN2CCN3CCN(CCC3C2=O)C(CCc2ccccc2OC)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1473 |
| logD: | 3.1424 |
| logSw: | -3.1256 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.905 |
| InChI Key: | UNTUWGSCAKMWRU-QHCPKHFHSA-N |