2-[(4-fluorophenyl)methyl]-8-(1H-pyrazole-3-carbonyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
2-[(4-fluorophenyl)methyl]-8-(1H-pyrazole-3-carbonyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
2-[(4-fluorophenyl)methyl]-8-(1H-pyrazole-3-carbonyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0851 |
| Compound Name: | 2-[(4-fluorophenyl)methyl]-8-(1H-pyrazole-3-carbonyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 371.41 |
| Molecular Formula: | C19 H22 F N5 O2 |
| Smiles: | C1CN(CCN2CCN(Cc3ccc(cc3)F)C(C12)=O)C(c1cc[nH]n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7115 |
| logD: | 0.7099 |
| logSw: | -1.8623 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.404 |
| InChI Key: | XMSZWLAQAAFTEL-KRWDZBQOSA-N |