2-[(3-methylphenyl)methyl]-8-[3-(4-methyl-1H-pyrazol-1-yl)propanoyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
2-[(3-methylphenyl)methyl]-8-[3-(4-methyl-1H-pyrazol-1-yl)propanoyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
2-[(3-methylphenyl)methyl]-8-[3-(4-methyl-1H-pyrazol-1-yl)propanoyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0881 |
| Compound Name: | 2-[(3-methylphenyl)methyl]-8-[3-(4-methyl-1H-pyrazol-1-yl)propanoyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 423.51 |
| Molecular Formula: | C23 H29 N5 O3 |
| Smiles: | Cc1cccc(CN2CC(N3CCN(CCC3C2=O)C(CCn2cc(C)cn2)=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8669 |
| logD: | 0.8669 |
| logSw: | -1.3804 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.318 |
| InChI Key: | VXOOACZYGSMONU-FQEVSTJZSA-N |