8-acetyl-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
8-acetyl-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
8-acetyl-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0493 |
| Compound Name: | 8-acetyl-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 315.41 |
| Molecular Formula: | C18 H25 N3 O2 |
| Smiles: | CC(N1CCC2C(N(CCN2CC1)Cc1cccc(C)c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4222 |
| logD: | 1.4181 |
| logSw: | -1.6934 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.542 |
| InChI Key: | FLFHJSZXIPFQDL-KRWDZBQOSA-N |