3'-[(3-methylbenzamido)methyl]-N-(2-methylpropyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazine]-1-carboxamide
Chemical Structure Depiction of
3'-[(3-methylbenzamido)methyl]-N-(2-methylpropyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazine]-1-carboxamide
3'-[(3-methylbenzamido)methyl]-N-(2-methylpropyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazine]-1-carboxamide
Compound characteristics
| Compound ID: | SD07-0305 |
| Compound Name: | 3'-[(3-methylbenzamido)methyl]-N-(2-methylpropyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazine]-1-carboxamide |
| Molecular Weight: | 426.52 |
| Molecular Formula: | C22 H30 N6 O3 |
| Smiles: | CC(C)CNC(N1CCC2(C1)Cn1c(CO2)c(CNC(c2cccc(C)c2)=O)nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.782 |
| logD: | 1.782 |
| logSw: | -2.3182 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.858 |
| InChI Key: | NXJMMLYIDOBFDN-QFIPXVFZSA-N |