N-{[1-(1-methyl-1H-pyrazole-5-carbonyl)-4'H,7'H-spiro[piperidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}oxane-4-carboxamide
Chemical Structure Depiction of
N-{[1-(1-methyl-1H-pyrazole-5-carbonyl)-4'H,7'H-spiro[piperidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}oxane-4-carboxamide
N-{[1-(1-methyl-1H-pyrazole-5-carbonyl)-4'H,7'H-spiro[piperidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}oxane-4-carboxamide
Compound characteristics
| Compound ID: | SD08-1014 |
| Compound Name: | N-{[1-(1-methyl-1H-pyrazole-5-carbonyl)-4'H,7'H-spiro[piperidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}oxane-4-carboxamide |
| Molecular Weight: | 443.5 |
| Molecular Formula: | C21 H29 N7 O4 |
| Smiles: | Cn1c(ccn1)C(N1CCCC2(C1)Cn1c(CO2)c(CNC(C2CCOCC2)=O)nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.9679 |
| logD: | -0.9679 |
| logSw: | -1.485 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.828 |
| InChI Key: | VACIFOKUDLUFNL-OAQYLSRUSA-N |