9-(1H-indazole-3-carbonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
9-(1H-indazole-3-carbonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
9-(1H-indazole-3-carbonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | SD68-0681 |
| Compound Name: | 9-(1H-indazole-3-carbonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 417.51 |
| Molecular Formula: | C24 H27 N5 O2 |
| Smiles: | Cc1cccc(CN2CCN3CCCN(CC3C2=O)C(c2c3ccccc3[nH]n2)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5914 |
| logD: | 2.5898 |
| logSw: | -2.9513 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.983 |
| InChI Key: | JAWJCWDEICHJHE-NRFANRHFSA-N |