2-[(4-fluorophenyl)methyl]-9-(4-methoxy-2-methylbenzoyl)octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
2-[(4-fluorophenyl)methyl]-9-(4-methoxy-2-methylbenzoyl)octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
2-[(4-fluorophenyl)methyl]-9-(4-methoxy-2-methylbenzoyl)octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | SD68-0830 |
| Compound Name: | 2-[(4-fluorophenyl)methyl]-9-(4-methoxy-2-methylbenzoyl)octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 425.5 |
| Molecular Formula: | C24 H28 F N3 O3 |
| Smiles: | Cc1cc(ccc1C(N1CCCN2CCN(Cc3ccc(cc3)F)C(C2C1)=O)=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5234 |
| logD: | 2.5226 |
| logSw: | -2.7988 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.28 |
| InChI Key: | OFOZJZIQRZUDBM-QFIPXVFZSA-N |