8-[(4-chlorophenyl)acetyl]-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
8-[(4-chlorophenyl)acetyl]-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
8-[(4-chlorophenyl)acetyl]-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0433 |
| Compound Name: | 8-[(4-chlorophenyl)acetyl]-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 425.96 |
| Molecular Formula: | C24 H28 Cl N3 O2 |
| Smiles: | Cc1cccc(CN2CCN3CCN(CCC3C2=O)C(Cc2ccc(cc2)[Cl])=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4453 |
| logD: | 3.4395 |
| logSw: | -3.6543 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.275 |
| InChI Key: | ZMWBXROQEYJFHJ-JOCHJYFZSA-N |