8-(3-methylbutanoyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
8-(3-methylbutanoyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
8-(3-methylbutanoyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0809 |
| Compound Name: | 8-(3-methylbutanoyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 371.48 |
| Molecular Formula: | C21 H29 N3 O3 |
| Smiles: | CC(C)CC(N1CCC2C(N(CC(N2CC1)=O)Cc1cccc(C)c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.951 |
| logD: | 1.951 |
| logSw: | -2.2692 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.834 |
| InChI Key: | BGFLSYAHPKRYFY-SFHVURJKSA-N |