8-(methoxyacetyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
8-(methoxyacetyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
8-(methoxyacetyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0420 |
| Compound Name: | 8-(methoxyacetyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 345.44 |
| Molecular Formula: | C19 H27 N3 O3 |
| Smiles: | Cc1cccc(CN2CCN3CCN(CCC3C2=O)C(COC)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7366 |
| logD: | 0.7312 |
| logSw: | -1.3831 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.97 |
| InChI Key: | UJDRDQQRLXVRLZ-KRWDZBQOSA-N |