2-[(3-fluorophenyl)methyl]-N-(3-methylbutyl)-1,4-dioxooctahydropyrazino[1,2-d][1,4]diazepine-8(2H)-carboxamide
Chemical Structure Depiction of
2-[(3-fluorophenyl)methyl]-N-(3-methylbutyl)-1,4-dioxooctahydropyrazino[1,2-d][1,4]diazepine-8(2H)-carboxamide
2-[(3-fluorophenyl)methyl]-N-(3-methylbutyl)-1,4-dioxooctahydropyrazino[1,2-d][1,4]diazepine-8(2H)-carboxamide
Compound characteristics
| Compound ID: | S993-0476 |
| Compound Name: | 2-[(3-fluorophenyl)methyl]-N-(3-methylbutyl)-1,4-dioxooctahydropyrazino[1,2-d][1,4]diazepine-8(2H)-carboxamide |
| Molecular Weight: | 404.48 |
| Molecular Formula: | C21 H29 F N4 O3 |
| Smiles: | CC(C)CCNC(N1CCC2C(N(CC(N2CC1)=O)Cc1cccc(c1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9628 |
| logD: | 1.9628 |
| logSw: | -2.5812 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.346 |
| InChI Key: | IZRPVDGRVDQTSC-SFHVURJKSA-N |