2-[(3-methylphenyl)methyl]-8-propanoyloctahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
2-[(3-methylphenyl)methyl]-8-propanoyloctahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
2-[(3-methylphenyl)methyl]-8-propanoyloctahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0487 |
| Compound Name: | 2-[(3-methylphenyl)methyl]-8-propanoyloctahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 329.44 |
| Molecular Formula: | C19 H27 N3 O2 |
| Smiles: | CCC(N1CCC2C(N(CCN2CC1)Cc1cccc(C)c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7833 |
| logD: | 1.7783 |
| logSw: | -2.0157 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.547 |
| InChI Key: | NKVMHUKMKSIKCZ-KRWDZBQOSA-N |