(3S,5R)-3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-7-(2-methylpropanoyl)-2,7-diazaspiro[4.4]nonan-1-one
Chemical Structure Depiction of
(3S,5R)-3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-7-(2-methylpropanoyl)-2,7-diazaspiro[4.4]nonan-1-one
(3S,5R)-3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-7-(2-methylpropanoyl)-2,7-diazaspiro[4.4]nonan-1-one
Compound characteristics
| Compound ID: | SB74-0496 |
| Compound Name: | (3S,5R)-3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-7-(2-methylpropanoyl)-2,7-diazaspiro[4.4]nonan-1-one |
| Molecular Weight: | 426.56 |
| Molecular Formula: | C24 H34 N4 O3 |
| Smiles: | CC(C)C(N1CC[C@@]2(C[C@@H](C(N3CCN(CC3)c3cccc(C)c3C)=O)NC2=O)C1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.4553 |
| logD: | 2.4505 |
| logSw: | -2.5567 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.863 |
| InChI Key: | AATYGOKHVMWOIG-NTKDMRAZSA-N |