N,N-dimethyl-N'-{[1-(1-methyl-1H-pyrrole-2-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-methyl-1H-pyrrole-2-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-methyl-1H-pyrrole-2-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: | SD08-0589 |
| Compound Name: | N,N-dimethyl-N'-{[1-(1-methyl-1H-pyrrole-2-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: | 401.47 |
| Molecular Formula: | C19 H27 N7 O3 |
| Smiles: | CN(C)C(NCc1c2COC3(CCCN(C3)C(c3cccn3C)=O)Cn2nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.1311 |
| logD: | 0.1311 |
| logSw: | -1.6819 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.225 |
| InChI Key: | WNCNGSFJGOTBOH-LJQANCHMSA-N |