2-[(4-fluorophenyl)methyl]-9-(thiophene-2-carbonyl)octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
2-[(4-fluorophenyl)methyl]-9-(thiophene-2-carbonyl)octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
2-[(4-fluorophenyl)methyl]-9-(thiophene-2-carbonyl)octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | SD68-0807 |
| Compound Name: | 2-[(4-fluorophenyl)methyl]-9-(thiophene-2-carbonyl)octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 387.47 |
| Molecular Formula: | C20 H22 F N3 O2 S |
| Smiles: | C1CN2CCN(Cc3ccc(cc3)F)C(C2CN(C1)C(c1cccs1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0883 |
| logD: | 2.0868 |
| logSw: | -2.4586 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.754 |
| InChI Key: | ZLJIPIHBCAGDDS-KRWDZBQOSA-N |