N-{[1-(3-fluoropyridine-2-carbonyl)-4'H,7'H-spiro[piperidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}-3-methylbutanamide
Chemical Structure Depiction of
N-{[1-(3-fluoropyridine-2-carbonyl)-4'H,7'H-spiro[piperidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}-3-methylbutanamide
N-{[1-(3-fluoropyridine-2-carbonyl)-4'H,7'H-spiro[piperidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}-3-methylbutanamide
Compound characteristics
| Compound ID: | SD08-0891 |
| Compound Name: | N-{[1-(3-fluoropyridine-2-carbonyl)-4'H,7'H-spiro[piperidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}-3-methylbutanamide |
| Molecular Weight: | 430.48 |
| Molecular Formula: | C21 H27 F N6 O3 |
| Smiles: | CC(C)CC(NCc1c2COC3(CCCN(C3)C(c3c(cccn3)F)=O)Cn2nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7382 |
| logD: | 0.7382 |
| logSw: | -1.8062 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.954 |
| InChI Key: | RQRIGZKXSLKVNK-OAQYLSRUSA-N |