9-(6-methoxypyridine-3-carbonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
9-(6-methoxypyridine-3-carbonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
9-(6-methoxypyridine-3-carbonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | SD68-0702 |
| Compound Name: | 9-(6-methoxypyridine-3-carbonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 408.5 |
| Molecular Formula: | C23 H28 N4 O3 |
| Smiles: | Cc1cccc(CN2CCN3CCCN(CC3C2=O)C(c2ccc(nc2)OC)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0327 |
| logD: | 2.032 |
| logSw: | -2.272 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.318 |
| InChI Key: | PGRNDEHOKYPTNJ-FQEVSTJZSA-N |