1-ethyl-N-{[1-(1-methyl-1H-imidazole-5-carbonyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
1-ethyl-N-{[1-(1-methyl-1H-imidazole-5-carbonyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}-1H-pyrazole-5-carboxamide
1-ethyl-N-{[1-(1-methyl-1H-imidazole-5-carbonyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | SD07-0909 |
| Compound Name: | 1-ethyl-N-{[1-(1-methyl-1H-imidazole-5-carbonyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 439.48 |
| Molecular Formula: | C20 H25 N9 O3 |
| Smiles: | CCn1c(ccn1)C(NCc1c2COC3(CCN(C3)C(c3cncn3C)=O)Cn2nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -1.134 |
| logD: | -1.1703 |
| logSw: | -1.1961 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.778 |
| InChI Key: | BKPAZZGHWMNULU-FQEVSTJZSA-N |