N-ethyl-3'-{[(1-ethyl-1H-pyrazole-5-carbonyl)amino]methyl}-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazine]-1-carboxamide
Chemical Structure Depiction of
N-ethyl-3'-{[(1-ethyl-1H-pyrazole-5-carbonyl)amino]methyl}-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazine]-1-carboxamide
N-ethyl-3'-{[(1-ethyl-1H-pyrazole-5-carbonyl)amino]methyl}-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazine]-1-carboxamide
Compound characteristics
Compound ID: | SD07-0978 |
Compound Name: | N-ethyl-3'-{[(1-ethyl-1H-pyrazole-5-carbonyl)amino]methyl}-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazine]-1-carboxamide |
Molecular Weight: | 402.45 |
Molecular Formula: | C18 H26 N8 O3 |
Smiles: | CCNC(N1CCC2(C1)Cn1c(CO2)c(CNC(c2ccnn2CC)=O)nn1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | -0.5318 |
logD: | -0.5318 |
logSw: | -1.7786 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 98.573 |
InChI Key: | TYFSEQOKTRFXKU-SFHVURJKSA-N |