N-(2-fluorophenyl)-2-[(3-fluorophenyl)methyl]-1,4-dioxooctahydropyrazino[1,2-d][1,4]diazepine-8(2H)-carboxamide
Chemical Structure Depiction of
N-(2-fluorophenyl)-2-[(3-fluorophenyl)methyl]-1,4-dioxooctahydropyrazino[1,2-d][1,4]diazepine-8(2H)-carboxamide
N-(2-fluorophenyl)-2-[(3-fluorophenyl)methyl]-1,4-dioxooctahydropyrazino[1,2-d][1,4]diazepine-8(2H)-carboxamide
Compound characteristics
| Compound ID: | S993-1131 |
| Compound Name: | N-(2-fluorophenyl)-2-[(3-fluorophenyl)methyl]-1,4-dioxooctahydropyrazino[1,2-d][1,4]diazepine-8(2H)-carboxamide |
| Molecular Weight: | 428.44 |
| Molecular Formula: | C22 H22 F2 N4 O3 |
| Smiles: | C1CN(CCN2C1C(N(CC2=O)Cc1cccc(c1)F)=O)C(Nc1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.002 |
| logD: | 2.002 |
| logSw: | -2.6406 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.213 |
| InChI Key: | VETXUUDATWAAQL-LJQANCHMSA-N |