N,N-diethyl-N'-{[1-(6-methylpyridine-3-carbonyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}urea
Chemical Structure Depiction of
N,N-diethyl-N'-{[1-(6-methylpyridine-3-carbonyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}urea
N,N-diethyl-N'-{[1-(6-methylpyridine-3-carbonyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}urea
Compound characteristics
| Compound ID: | SD07-0677 |
| Compound Name: | N,N-diethyl-N'-{[1-(6-methylpyridine-3-carbonyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}urea |
| Molecular Weight: | 427.51 |
| Molecular Formula: | C21 H29 N7 O3 |
| Smiles: | CCN(CC)C(NCc1c2COC3(CCN(C3)C(c3ccc(C)nc3)=O)Cn2nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.1646 |
| logD: | 0.1643 |
| logSw: | -1.7866 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.049 |
| InChI Key: | HIXMDKZAFHBAES-NRFANRHFSA-N |