1-butyl-5-methyl-3,7-diazabicyclo[3.3.1]nonan-9-one
Chemical Structure Depiction of
1-butyl-5-methyl-3,7-diazabicyclo[3.3.1]nonan-9-one
1-butyl-5-methyl-3,7-diazabicyclo[3.3.1]nonan-9-one
Compound characteristics
| Compound ID: | D171-0167 |
| Compound Name: | 1-butyl-5-methyl-3,7-diazabicyclo[3.3.1]nonan-9-one |
| Molecular Weight: | 210.32 |
| Molecular Formula: | C12 H22 N2 O |
| Smiles: | CCCCC12CNCC(C)(CNC1)C2=O |
| Stereo: | ACHIRAL |
| logP: | 1.4812 |
| logD: | 1.3934 |
| logSw: | -1.0902 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 37.143 |
| InChI Key: | KLRNBGWBFNKQRE-UHFFFAOYSA-N |