N,N-dimethyl-N'-{[1-(1,3,5-trimethyl-1H-pyrazole-4-carbonyl)-4'H,7'H-spiro[piperidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}urea
Chemical Structure Depiction of
N,N-dimethyl-N'-{[1-(1,3,5-trimethyl-1H-pyrazole-4-carbonyl)-4'H,7'H-spiro[piperidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}urea
N,N-dimethyl-N'-{[1-(1,3,5-trimethyl-1H-pyrazole-4-carbonyl)-4'H,7'H-spiro[piperidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}urea
Compound characteristics
| Compound ID: | SD08-0556 |
| Compound Name: | N,N-dimethyl-N'-{[1-(1,3,5-trimethyl-1H-pyrazole-4-carbonyl)-4'H,7'H-spiro[piperidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}urea |
| Molecular Weight: | 430.51 |
| Molecular Formula: | C20 H30 N8 O3 |
| Smiles: | Cc1c(C(N2CCCC3(C2)Cn2c(CO3)c(CNC(N(C)C)=O)nn2)=O)c(C)n(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | -1.4125 |
| logD: | -1.4125 |
| logSw: | -0.5064 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.647 |
| InChI Key: | NTFYOOGKTKUBHU-HXUWFJFHSA-N |