methyl [1,5-dimethyl-9-oxo-7-(propylcarbamothioyl)-3,7-diazabicyclo[3.3.1]nonan-3-yl](oxo)acetate
Chemical Structure Depiction of
methyl [1,5-dimethyl-9-oxo-7-(propylcarbamothioyl)-3,7-diazabicyclo[3.3.1]nonan-3-yl](oxo)acetate
methyl [1,5-dimethyl-9-oxo-7-(propylcarbamothioyl)-3,7-diazabicyclo[3.3.1]nonan-3-yl](oxo)acetate
Compound characteristics
| Compound ID: | 3473-3283 |
| Compound Name: | methyl [1,5-dimethyl-9-oxo-7-(propylcarbamothioyl)-3,7-diazabicyclo[3.3.1]nonan-3-yl](oxo)acetate |
| Molecular Weight: | 355.45 |
| Molecular Formula: | C16 H25 N3 O4 S |
| Smiles: | CCCNC(N1CC2(C)CN(CC(C)(C1)C2=O)C(C(=O)OC)=O)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.3352 |
| logD: | 1.3352 |
| logSw: | -1.678 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.274 |
| InChI Key: | FDTRTJWWKDMALN-UHFFFAOYSA-N |